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Diazanaftalenos

Compuestos heterocíclicos orgánicos que constan de un anillo doble de naftaleno en el que dos de los átomos de carbono han sido reemplazados por átomos de nitrógeno.
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1

Fenazina Etosulfato, TRC

CAS: 10510-77-7 Fórmula molecular: C14H13N2 .C2H5O4S Peso molecular (g/mol): 334.4 Sinónimo: N-Ethylphenazinium Ethyl Sulfate,N-Ethylphenazonium Ethyl Sulfate,NSC 402863 Nombre IUPAC: (E)-3-(2,5-dimetilanilino)-1-fenilprop-2-en-1-uno SMILES: Cc1ccc(C)c(N\C=C\C(=O)c2ccccc2)c1

Sinónimo N-Ethylphenazinium Ethyl Sulfate,N-Ethylphenazonium Ethyl Sulfate,NSC 402863
Fórmula molecular C14H13N2 .C2H5O4S
CAS 10510-77-7
Peso molecular (g/mol) 334.4
SMILES Cc1ccc(C)c(N\C=C\C(=O)c2ccccc2)c1
Nombre IUPAC (E)-3-(2,5-dimetilanilino)-1-fenilprop-2-en-1-uno
2

Dihidrocloruro de Vatalanib, TRC

CAS: 212141-51-0 Fórmula molecular: C20 H15 Cl N4 . 2 Cl H Peso molecular (g/mol): 419.73 Sinónimo: 1-Phthalazinamine, N-(4-chlorophenyl)-4-(4-pyridinylmethyl)-, hydrochloride (1:2),1-Phthalazinamine, N-(4-chlorophenyl)-4-(4-pyridinylmethyl)-, dihydrochloride (9CI),Vatalanib dihydrochloride Nombre IUPAC: N-(4-clorofenil)-4-(piridina-4-ilmetil)ftalazina-1-amina; Dihidrocloruro SMILES: Cl.Cl.Clc1ccc(Nc2nnc(Cc3ccncc3)c4ccccc24)cc1

Sinónimo 1-Phthalazinamine, N-(4-chlorophenyl)-4-(4-pyridinylmethyl)-, hydrochloride (1:2),1-Phthalazinamine, N-(4-chlorophenyl)-4-(4-pyridinylmethyl)-, dihydrochloride (9CI),Vatalanib dihydrochloride
Fórmula molecular C20 H15 Cl N4 . 2 Cl H
CAS 212141-51-0
Peso molecular (g/mol) 419.73
SMILES Cl.Cl.Clc1ccc(Nc2nnc(Cc3ccncc3)c4ccccc24)cc1
Nombre IUPAC N-(4-clorofenil)-4-(piridina-4-ilmetil)ftalazina-1-amina; Dihidrocloruro
3

2-Amino-3,4,8-trimetil-3H-imidazo[4,5-f]quinoxalina, TRC

CAS: 95896-78-9 Fórmula molecular: C12 H13 N5 Peso molecular (g/mol): 227.27 Sinónimo: 3H-Imidazo[4,5-f]quinoxalin-2-amine, 3,4,8-trimethyl-,3,4,8-Trimethyl-3H-imidazo[4,5-f]quinoxalin-2-amine,2-Amino-3,4,8-trimethyl-3H-imidazo[4,5-f]quinoxaline,2-Amino-3,4,8-trimethylimidazo[4,5-f]quinoxaline,4,8-DiMeIQx Nombre IUPAC: 3,4,8-trimetilimidazo[4,5-f]quinoxalina-2-amina SMILES: Cc1cnc2cc(C)c3c(nc(N)n3C)c2n1

Sinónimo 3H-Imidazo[4,5-f]quinoxalin-2-amine, 3,4,8-trimethyl-,3,4,8-Trimethyl-3H-imidazo[4,5-f]quinoxalin-2-amine,2-Amino-3,4,8-trimethyl-3H-imidazo[4,5-f]quinoxaline,2-Amino-3,4,8-trimethylimidazo[4,5-f]quinoxaline,4,8-DiMeIQx
Fórmula molecular C12 H13 N5
CAS 95896-78-9
Peso molecular (g/mol) 227.27
SMILES Cc1cnc2cc(C)c3c(nc(N)n3C)c2n1
Nombre IUPAC 3,4,8-trimetilimidazo[4,5-f]quinoxalina-2-amina
4

6,7-Dimetoxiquinazolina-2,4-diona, TRC

CAS: 28888-44-0 Fórmula molecular: C10 H10 N2 O4 Peso molecular (g/mol): 222.2 Sinónimo: 6,7-Dimethoxyquinazoline-2,4(1H,3H)-dione,Doxazosin Mesilate Imp. D (EP),2,4(1H,3H)-Quinazolinedione, 6,7-dimethoxy-,6,7-Dimethoxy-2,4(1H,3H)-quinazolinedione,2,5-Dihydroxy-6,7-dimethoxyquinazoline,6,7-Dimethoxy-1H-quinazoline-2,4-dione,6,7-Dimethoxyquinazoline-2,4-diol,6,7-Dimethoxyquinazoline-2,4-dione Nombre IUPAC: 6,7-dimetil-1H-quinazolina-2,4-diona SMILES: COc1cc2NC(=O)NC(=O)c2cc1OC

Sinónimo 6,7-Dimethoxyquinazoline-2,4(1H,3H)-dione,Doxazosin Mesilate Imp. D (EP),2,4(1H,3H)-Quinazolinedione, 6,7-dimethoxy-,6,7-Dimethoxy-2,4(1H,3H)-quinazolinedione,2,5-Dihydroxy-6,7-dimethoxyquinazoline,6,7-Dimethoxy-1H-quinazoline-2,4-dione,6,7-Dimethoxyquinazoline-2,4-diol,6,7-Dimethoxyquinazoline-2,4-dione
Fórmula molecular C10 H10 N2 O4
CAS 28888-44-0
Peso molecular (g/mol) 222.2
SMILES COc1cc2NC(=O)NC(=O)c2cc1OC
Nombre IUPAC 6,7-dimetil-1H-quinazolina-2,4-diona
5

Olaquindox, TRC

CAS: 23696-28-8 Fórmula molecular: C12 H13 N3 O4 Peso molecular (g/mol): 263.25 Sinónimo: 2-[N-(2-Hydroxyethyl)carboxamide]-3-methylquinoxaline 1,4-dioxide,Bayernox,BayoNox,Bisergon,NSC 634933,Olaquindox Nombre IUPAC: N-(2-hidroxietil)-3-metil-1,4-dioxidoquinoxalina-1,4-diio-2-carboxamida SMILES: Cc1c(C(=O)NCCO)[n+]([O-])c2ccccc2[n+]1[O-]

Sinónimo 2-[N-(2-Hydroxyethyl)carboxamide]-3-methylquinoxaline 1,4-dioxide,Bayernox,BayoNox,Bisergon,NSC 634933,Olaquindox
Fórmula molecular C12 H13 N3 O4
CAS 23696-28-8
Peso molecular (g/mol) 263.25
SMILES Cc1c(C(=O)NCCO)[n+]([O-])c2ccccc2[n+]1[O-]
Nombre IUPAC N-(2-hidroxietil)-3-metil-1,4-dioxidoquinoxalina-1,4-diio-2-carboxamida
6

Ditosilato de Lapatinib, TRC

CAS: 388082-77-7 Fórmula molecular: C29 H26 Cl F N4 O4 S . 2 C7 H8 O3 S Peso molecular (g/mol): 925.46 Sinónimo: 4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]amino]methyl]-2-furanyl]-, 4-methylbenzenesulfonate (1:2),4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]amino]methyl]-2-furanyl]-, bis(4-methylbenzenesulfonate) (9CI),GW 572016F,Lapatinib ditosylate,Tykerb Nombre IUPAC: N-[3-cloro-4-[(3-fluorofenil)metoxi]fenil]-6-[5-[(2-metilsulfoniletilamino)metilfurano-2-il]quinazolina-4-amina; Ácido 4-metilbenzenosulfónico SMILES: Cc1ccc(cc1)S(=O)(=O)O.Cc2ccc(cc2)S(=O)(=O)O.CS(=O)(=O)CCNCc3oc(cc3)c4ccc5ncnc(Nc6ccc(OCc7cccc(F)c7)c(Cl)c6)c5c4

Sinónimo 4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]amino]methyl]-2-furanyl]-, 4-methylbenzenesulfonate (1:2),4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]amino]methyl]-2-furanyl]-, bis(4-methylbenzenesulfonate) (9CI),GW 572016F,Lapatinib ditosylate,Tykerb
Fórmula molecular C29 H26 Cl F N4 O4 S . 2 C7 H8 O3 S
CAS 388082-77-7
Peso molecular (g/mol) 925.46
SMILES Cc1ccc(cc1)S(=O)(=O)O.Cc2ccc(cc2)S(=O)(=O)O.CS(=O)(=O)CCNCc3oc(cc3)c4ccc5ncnc(Nc6ccc(OCc7cccc(F)c7)c(Cl)c6)c5c4
Nombre IUPAC N-[3-cloro-4-[(3-fluorofenil)metoxi]fenil]-6-[5-[(2-metilsulfoniletilamino)metilfurano-2-il]quinazolina-4-amina; Ácido 4-metilbenzenosulfónico
7

2-Amino-3,8-dimetilimidazo[4,5-f]quinoxalina, TRC

CAS: 77500-04-0 Fórmula molecular: C11 H11 N5 Peso molecular (g/mol): 213.24 Sinónimo: 3H-Imidazo[4,5-f]quinoxalin-2-amine, 3,8-dimethyl-,3,8-Dimethyl-3H-imidazo[4,5-f]quinoxalin-2-amine,2-Amino-3,8-dimethylimidazo[4,5-f]quinoxaline,2-Amino-3,8-dimethylmidazo[4,5-f]quinoxaline,MeIQx Nombre IUPAC: 3,8-dimetilimidazo[4,5-f]quinoxalina-2-amina SMILES: Cc1cnc2ccc3c(nc(N)n3C)c2n1

Sinónimo 3H-Imidazo[4,5-f]quinoxalin-2-amine, 3,8-dimethyl-,3,8-Dimethyl-3H-imidazo[4,5-f]quinoxalin-2-amine,2-Amino-3,8-dimethylimidazo[4,5-f]quinoxaline,2-Amino-3,8-dimethylmidazo[4,5-f]quinoxaline,MeIQx
Fórmula molecular C11 H11 N5
CAS 77500-04-0
Peso molecular (g/mol) 213.24
SMILES Cc1cnc2ccc3c(nc(N)n3C)c2n1
Nombre IUPAC 3,8-dimetilimidazo[4,5-f]quinoxalina-2-amina
8

Óxido de azelastina n (mezcla de diasetéromeros), TRC

CAS: 640279-88-5 Fórmula molecular: C22 H24 Cl N3 O2 Peso molecular (g/mol): 397.9 Sinónimo: 1(2H)-Phthalazinone, 4-[(4-chlorophenyl)methyl]-2-(hexahydro-1-methyl-1-oxido-1H-azepin-4-yl)-,Azelastine N-Oxide Nombre IUPAC: 4-[(4-clorofenil)metil]-2-(1-metil-1-oxidoazép-1-ium-4-il)ftalazina-1-una SMILES: C[N+]1([O-])CCCC(CC1)N2N=C(Cc3ccc(Cl)cc3)c4ccccc4C2=O

Sinónimo 1(2H)-Phthalazinone, 4-[(4-chlorophenyl)methyl]-2-(hexahydro-1-methyl-1-oxido-1H-azepin-4-yl)-,Azelastine N-Oxide
Fórmula molecular C22 H24 Cl N3 O2
CAS 640279-88-5
Peso molecular (g/mol) 397.9
SMILES C[N+]1([O-])CCCC(CC1)N2N=C(Cc3ccc(Cl)cc3)c4ccccc4C2=O
Nombre IUPAC 4-[(4-clorofenil)metil]-2-(1-metil-1-oxidoazép-1-ium-4-il)ftalazina-1-una
9

4-[(4-Clorofenil)metil]-2-[2-(1-metil-2-pirrolidinil)etil]-1(2H)-ftalazinona Cloruro, TRC

CAS: 117078-70-3 Fórmula molecular: C22H24ClN3O . HCl Peso molecular (g/mol): 381.9 Sinónimo: Azelastine 5-Member-Cyclic-Isomer Hcl Nombre IUPAC: 4-[(4-clorofenil)metil]-2-[2-(1-metilpirrolidina-2-il)etil]ftalazina-1-una SMILES: Cl.CN1CCCC1CCN2N=C(Cc3ccc(Cl)cc3)c4ccccc4C2=O

Sinónimo Azelastine 5-Member-Cyclic-Isomer Hcl
Fórmula molecular C22H24ClN3O . HCl
CAS 117078-70-3
Peso molecular (g/mol) 381.9
SMILES Cl.CN1CCCC1CCN2N=C(Cc3ccc(Cl)cc3)c4ccccc4C2=O
Nombre IUPAC 4-[(4-clorofenil)metil]-2-[2-(1-metilpirrolidina-2-il)etil]ftalazina-1-una
10

O-Desmorfoolinopropil Gefitinib, TRC

CAS: 184475-71-6 Fórmula molecular: C15 H11 Cl F N3 O2 Peso molecular (g/mol): 319.72 Sinónimo: 6-Quinazolinol, 4-[(3-chloro-4-fluorophenyl)amino]-7-methoxy-,4-[(3-Chloro-4-fluorophenyl)amino]-7-methoxy-6-quinazolinol,4-(3-Chloro-4-fluoroanilino)-6-hydroxy-7-methoxyquinazoline,4-(3-Chloro-4-fluorophenylamino)-6-hydroxy-7-methoxyquinazoline,4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-ol,N-(3-Chloro-4-fluorophenyl)-6-hydroxy-7-methoxyquinazolin-4-amine,O-Desmorpholinopropyl Gefitinib Nombre IUPAC: 4-(3-cloro-4-fluoroanilino)-7-metoxiquinazolina-6-ol SMILES: COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1O

Sinónimo 6-Quinazolinol, 4-[(3-chloro-4-fluorophenyl)amino]-7-methoxy-,4-[(3-Chloro-4-fluorophenyl)amino]-7-methoxy-6-quinazolinol,4-(3-Chloro-4-fluoroanilino)-6-hydroxy-7-methoxyquinazoline,4-(3-Chloro-4-fluorophenylamino)-6-hydroxy-7-methoxyquinazoline,4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-ol,N-(3-Chloro-4-fluorophenyl)-6-hydroxy-7-methoxyquinazolin-4-amine,O-Desmorpholinopropyl Gefitinib
Fórmula molecular C15 H11 Cl F N3 O2
CAS 184475-71-6
Peso molecular (g/mol) 319.72
SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1O
Nombre IUPAC 4-(3-cloro-4-fluoroanilino)-7-metoxiquinazolina-6-ol
11

Cinoxacina, TRC

CAS: 28657-80-9 Fórmula molecular: C12 H10 N2 O5 Peso molecular (g/mol): 262.22 Sinónimo: [1,3]Dioxolo[4,5-g]cinnoline-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-,1-Ethyl-3-carboxy-6,7-methylenedioxy-4-cinnolone,Cinobac,Cinobactin,Cinoxacin,Compound 64716,NSC 304467,Noxigram,Uronorm Nombre IUPAC: 1-etil-4-oxo-[1,3]dioxolo[4,5-g]cinnolina-3-carboxílico ácido SMILES: CCN1N=C(C(=O)O)C(=O)c2cc3OCOc3cc12

Sinónimo [1,3]Dioxolo[4,5-g]cinnoline-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-,1-Ethyl-3-carboxy-6,7-methylenedioxy-4-cinnolone,Cinobac,Cinobactin,Cinoxacin,Compound 64716,NSC 304467,Noxigram,Uronorm
Fórmula molecular C12 H10 N2 O5
CAS 28657-80-9
Peso molecular (g/mol) 262.22
SMILES CCN1N=C(C(=O)O)C(=O)c2cc3OCOc3cc12
Nombre IUPAC 1-etil-4-oxo-[1,3]dioxolo[4,5-g]cinnolina-3-carboxílico ácido
12

7-Methoxy-6-(3-morfolina 4-ilpropoxi)quinazolina-4(3H)-ona, TRC

CAS: 199327-61-2 Fórmula molecular: C16 H21 N3 O4 Peso molecular (g/mol): 319.36 Sinónimo: 4(3H)-Quinazolinone, 7-methoxy-6-[3-(4-morpholinyl)propoxy]-,4(1H)-Quinazolinone, 7-methoxy-6-[3-(4-morpholinyl)propoxy]- (9CI),7-Methoxy-6-[3-(4-morpholinyl)propoxy]-4(3H)-quinazolinone,7-Methoxy-6-(3-(morpholin-4-yl)propoxy)-3H-quinazolin-4-one,7-Methoxy-6-(3-morpholinopropoxy)-3,4-dihydroquinazolin-4-one,7-Methoxy-6-[3-(4-morpholinyl)propoxy]quinazolin-4(3H)-one,Gefitinib Imp. A (EP) Nombre IUPAC: 7-metaxi-6-(3-morfolina 4-ilpropoxi)-3H-quinazolina-4-una SMILES: COc1cc2N=CNC(=O)c2cc1OCCCN3CCOCC3

Sinónimo 4(3H)-Quinazolinone, 7-methoxy-6-[3-(4-morpholinyl)propoxy]-,4(1H)-Quinazolinone, 7-methoxy-6-[3-(4-morpholinyl)propoxy]- (9CI),7-Methoxy-6-[3-(4-morpholinyl)propoxy]-4(3H)-quinazolinone,7-Methoxy-6-(3-(morpholin-4-yl)propoxy)-3H-quinazolin-4-one,7-Methoxy-6-(3-morpholinopropoxy)-3,4-dihydroquinazolin-4-one,7-Methoxy-6-[3-(4-morpholinyl)propoxy]quinazolin-4(3H)-one,Gefitinib Imp. A (EP)
Fórmula molecular C16 H21 N3 O4
CAS 199327-61-2
Peso molecular (g/mol) 319.36
SMILES COc1cc2N=CNC(=O)c2cc1OCCCN3CCOCC3
Nombre IUPAC 7-metaxi-6-(3-morfolina 4-ilpropoxi)-3H-quinazolina-4-una
13

Sulfato de oftasina, TRC

CAS: 7327-87-9 Fórmula molecular: C8 H10 N6 . H2 O4 S Peso molecular (g/mol): 288.28 Sinónimo: Phthalazine, 1,4-dihydrazinyl-, sulfate (1:1),1,4-Phthalazinedione, 2,3-dihydro-, dihydrazone, sulfate (1:1) (9CI),Phthalazine, 1,4-dihydrazino-, sulfate (1:1) (8CI),1,4-Dihydrazinophthalazine sulfate,Depressan,Dihydralazine sulfate,Dihydrazinophthalazine sulfate,Dihyzin Nombre IUPAC: (Z)-[(4Z)-4-hidrazilideno-2,3-dihidroftalazina-1-ilideno]hidrazina; Ácido sulfúrico SMILES: N\N=C\1/NN\C(=N/N)\c2ccccc12.OS(=O)(=O)O

Sinónimo Phthalazine, 1,4-dihydrazinyl-, sulfate (1:1),1,4-Phthalazinedione, 2,3-dihydro-, dihydrazone, sulfate (1:1) (9CI),Phthalazine, 1,4-dihydrazino-, sulfate (1:1) (8CI),1,4-Dihydrazinophthalazine sulfate,Depressan,Dihydralazine sulfate,Dihydrazinophthalazine sulfate,Dihyzin
Fórmula molecular C8 H10 N6 . H2 O4 S
CAS 7327-87-9
Peso molecular (g/mol) 288.28
SMILES N\N=C\1/NN\C(=N/N)\c2ccccc12.OS(=O)(=O)O
Nombre IUPAC (Z)-[(4Z)-4-hidrazilideno-2,3-dihidroftalazina-1-ilideno]hidrazina; Ácido sulfúrico
14

6-Amino-5-bromoquinoxalina, TRC

CAS: 50358-63-9 Fórmula molecular: C8 H6 Br N3 Peso molecular (g/mol): 224.06 Sinónimo: 5-Bromo-6-quinoxalinamine,5-Bromo-6-aminoquinoxaline,5-Bromoquinoxalin-6-amine,6-Amino-5-bromoquinoxaline Nombre IUPAC: 5-bromoquinoxalina-6-amina SMILES: Nc1ccc2nccnc2c1Br

Sinónimo 5-Bromo-6-quinoxalinamine,5-Bromo-6-aminoquinoxaline,5-Bromoquinoxalin-6-amine,6-Amino-5-bromoquinoxaline
Fórmula molecular C8 H6 Br N3
CAS 50358-63-9
Peso molecular (g/mol) 224.06
SMILES Nc1ccc2nccnc2c1Br
Nombre IUPAC 5-bromoquinoxalina-6-amina