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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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2

2-Amino-3,4,7,8-tetrametil-3H-imidazo[4,5-f]quinoxalina, TRC

CAS: 132898-07-8 Fórmula molecular: C13 H15 N5 Peso molecular (g/mol): 241.29 Sinónimo: 3,4,7,8-Tetramethyl-3H-imidazo[4,5-f]quinoxalin-2-amine,2-Amino-3,4,7,8-tetramethyl-3H-imidazo[4,5-f]quinoxaline,2-Amino-3,4,7,8-tetramethylimidazo[4,5-f]quinoxaline,4,7,8-TriMeIQx Nombre IUPAC: 3,4,7,8-tetrametilimidazo[4,5-f]quinoxalina-2-amina SMILES: Cc1cc2nc(C)c(C)nc2c3nc(N)n(C)c13

Sinónimo 3,4,7,8-Tetramethyl-3H-imidazo[4,5-f]quinoxalin-2-amine,2-Amino-3,4,7,8-tetramethyl-3H-imidazo[4,5-f]quinoxaline,2-Amino-3,4,7,8-tetramethylimidazo[4,5-f]quinoxaline,4,7,8-TriMeIQx
Fórmula molecular C13 H15 N5
CAS 132898-07-8
Peso molecular (g/mol) 241.29
SMILES Cc1cc2nc(C)c(C)nc2c3nc(N)n(C)c13
Nombre IUPAC 3,4,7,8-tetrametilimidazo[4,5-f]quinoxalina-2-amina
3

(Z)-gemifloxacina mesilato, TRC

CAS: 210353-53-0 Fórmula molecular: C18 H20 F N5 O4 . C H4 O3 S Peso molecular (g/mol): 485.49 Sinónimo: 1,8-Naphthyridine-3-carboxylic acid, 7-[(4Z)-3-(aminomethyl)-4-(methoxyimino)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-, monomethanesulfonate,Factive,Floxguard,Gemifloxacin mesylate,Gemixa,LB 20304a,SB 265805S,Gemifloxacin Mesilate Nombre IUPAC: 7-[(4Z)-3-(aminometil)-4-metaxiiminopirrolidina-1-il]-1-ciclopropil-6-fluoro-4-oxo-1,8-naftiridina-3-ácido carboxílico; Ácido metanosulfónico SMILES: CO\N=C\1/CN(CC1CN)c2nc3N(C=C(C(=O)O)C(=O)c3cc2F)C4CC4.CS(=O)(=O)O

Sinónimo 1,8-Naphthyridine-3-carboxylic acid, 7-[(4Z)-3-(aminomethyl)-4-(methoxyimino)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-, monomethanesulfonate,Factive,Floxguard,Gemifloxacin mesylate,Gemixa,LB 20304a,SB 265805S,Gemifloxacin Mesilate
Fórmula molecular C18 H20 F N5 O4 . C H4 O3 S
CAS 210353-53-0
Peso molecular (g/mol) 485.49
SMILES CO\N=C\1/CN(CC1CN)c2nc3N(C=C(C(=O)O)C(=O)c3cc2F)C4CC4.CS(=O)(=O)O
Nombre IUPAC 7-[(4Z)-3-(aminometil)-4-metaxiiminopirrolidina-1-il]-1-ciclopropil-6-fluoro-4-oxo-1,8-naftiridina-3-ácido carboxílico; Ácido metanosulfónico
5

Clorhidrato de Azelastina, TRC

CAS: 79307-93-0 Fórmula molecular: C22 H24 Cl N3 O . Cl H Peso molecular (g/mol): 418.36 Sinónimo: 1(2H)-Phthalazinone, 4-[(4-chlorophenyl)methyl]-2-(hexahydro-1-methyl-1H-azepin-4-yl)-, hydrochloride (1:1),1(2H)-Phthalazinone, 4-[(4-chlorophenyl)methyl]-2-(hexahydro-1-methyl-1H-azepin-4-yl)-, monohydrochloride (9CI),A 5610,Allergodil,Astelin,Astepro,Azelast,Azelastine hydrochloride,Azeptin,E 0659,Optivar,Rhinolast,W 2979M,Zalastine Nombre IUPAC: 4-[(4-clorofenil)metil]-2-(1-metilazapán-4-il)ftalazina-1-una; Cloruro SMILES: Cl.CN1CCCC(CC1)N2N=C(Cc3ccc(Cl)cc3)c4ccccc4C2=O

Sinónimo 1(2H)-Phthalazinone, 4-[(4-chlorophenyl)methyl]-2-(hexahydro-1-methyl-1H-azepin-4-yl)-, hydrochloride (1:1),1(2H)-Phthalazinone, 4-[(4-chlorophenyl)methyl]-2-(hexahydro-1-methyl-1H-azepin-4-yl)-, monohydrochloride (9CI),A 5610,Allergodil,Astelin,Astepro,Azelast,Azelastine hydrochloride,Azeptin,E 0659,Optivar,Rhinolast,W 2979M,Zalastine
Fórmula molecular C22 H24 Cl N3 O . Cl H
CAS 79307-93-0
Peso molecular (g/mol) 418.36
SMILES Cl.CN1CCCC(CC1)N2N=C(Cc3ccc(Cl)cc3)c4ccccc4C2=O
Nombre IUPAC 4-[(4-clorofenil)metil]-2-(1-metilazapán-4-il)ftalazina-1-una; Cloruro
7

1-Aminoftalazina, TRC

CAS: 19064-69-8 Fórmula molecular: C8 H7 N3 Peso molecular (g/mol): 145.16 Nombre IUPAC: Ftalazina-1-amina SMILES: Nc1nncc2ccccc12

Fórmula molecular C8 H7 N3
CAS 19064-69-8
Peso molecular (g/mol) 145.16
SMILES Nc1nncc2ccccc12
Nombre IUPAC Ftalazina-1-amina
8

Desbromo Brimonidina, TRC

CAS: 91147-43-2 Fórmula molecular: C11 H11 N5 Peso molecular (g/mol): 213.24 Sinónimo: N-(4,5-Dihydro-1H-imidazol-2-yl)-6-quinoxalinamine,UK 41511 Nombre IUPAC: N-quinoxalina-6-ilimazolidina-2-imina SMILES: C1CNC(=Nc2ccc3nccnc3c2)N1

Sinónimo N-(4,5-Dihydro-1H-imidazol-2-yl)-6-quinoxalinamine,UK 41511
Fórmula molecular C11 H11 N5
CAS 91147-43-2
Peso molecular (g/mol) 213.24
SMILES C1CNC(=Nc2ccc3nccnc3c2)N1
Nombre IUPAC N-quinoxalina-6-ilimazolidina-2-imina
9

Hidrazida ftálica, TRC

CAS: 1445-69-8 Fórmula molecular: C8 H6 N2 O2 Peso molecular (g/mol): 162.15 Sinónimo: 2,3-Dihydro-1,4-phthalazinedione,1,2-Benzenedicarboxylic acid, cyclic hydrazide,1,4-Dihydroxyphthalazine,1,4-Phthalazinediol,4-Hydroxyphthalazin-1(2H)-one,Hydrazine, 1,2-(1,2-phenylenedicarbonyl)-,N,N'-Phthaloylhydrazine,NSC 201511,NSC 651,Phthalazine-1,4(2H,3H)-dione,Phthalhydrazide,Phthalic acid cyclic hydrazide,Phthalocyclohydrazide Nombre IUPAC: 2,3-dihidroftalazina-1,4-diona SMILES: O=C1NNC(=O)c2ccccc12

Sinónimo 2,3-Dihydro-1,4-phthalazinedione,1,2-Benzenedicarboxylic acid, cyclic hydrazide,1,4-Dihydroxyphthalazine,1,4-Phthalazinediol,4-Hydroxyphthalazin-1(2H)-one,Hydrazine, 1,2-(1,2-phenylenedicarbonyl)-,N,N'-Phthaloylhydrazine,NSC 201511,NSC 651,Phthalazine-1,4(2H,3H)-dione,Phthalhydrazide,Phthalic acid cyclic hydrazide,Phthalocyclohydrazide
Fórmula molecular C8 H6 N2 O2
CAS 1445-69-8
Peso molecular (g/mol) 162.15
SMILES O=C1NNC(=O)c2ccccc12
Nombre IUPAC 2,3-dihidroftalazina-1,4-diona
10

Gefitinib, TRC

CAS: 184475-35-2 Fórmula molecular: C22 H24 Cl F N4 O3 Peso molecular (g/mol): 446.9 Nombre IUPAC: N-(3-cloro-4-fluorofenil)-7-metaxi-6-(3-morfolina 4-ilpropoxi)quinazolina-4-amina SMILES: COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN4CCOCC4

Fórmula molecular C22 H24 Cl F N4 O3
CAS 184475-35-2
Peso molecular (g/mol) 446.9
SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN4CCOCC4
Nombre IUPAC N-(3-cloro-4-fluorofenil)-7-metaxi-6-(3-morfolina 4-ilpropoxi)quinazolina-4-amina
12

Quinocetona, TRC

CAS: 81810-66-4 Fórmula molecular: C18 H14 N2 O3 Peso molecular (g/mol): 306.32 Sinónimo: 2-Propen-1-one, 1-(3-methyl-2-quinoxalinyl)-3-phenyl-, N,N'-dioxide,1-(3-Methyl-1,4-dioxido-2-quinoxalinyl)-3-phenyl-2-propen-1-one,NSC 621477,Quinocetone Nombre IUPAC: (E)-1-(3-metil-1,4-dioxidoquinoxalina-1,4-diio-2-il)-3-fenilprop-2-en-1-one SMILES: Cc1c(C(=O)\C=C\c2ccccc2)[n+]([O-])c3ccccc3[n+]1[O-]

Sinónimo 2-Propen-1-one, 1-(3-methyl-2-quinoxalinyl)-3-phenyl-, N,N'-dioxide,1-(3-Methyl-1,4-dioxido-2-quinoxalinyl)-3-phenyl-2-propen-1-one,NSC 621477,Quinocetone
Fórmula molecular C18 H14 N2 O3
CAS 81810-66-4
Peso molecular (g/mol) 306.32
SMILES Cc1c(C(=O)\C=C\c2ccccc2)[n+]([O-])c3ccccc3[n+]1[O-]
Nombre IUPAC (E)-1-(3-metil-1,4-dioxidoquinoxalina-1,4-diio-2-il)-3-fenilprop-2-en-1-one
13

Trovafloxacina, TRC

CAS: 147059-72-1 Fórmula molecular: C20H15F3N4O3 Peso molecular (g/mol): 416.35 Sinónimo: 7-((1R,5S,6s)-6-amino-3-azabicyclo[3.1.0]hexan-3-yl)-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-1,8-naphthyridine-3-carboxylic Acid,Turvel,3-Azabicyclo[3.1.0]hexane, 1,8-naphthyridine-3-carboxylic acid derivative,7-[(1alpha,5alpha,6alpha)-6-Amino-3-azabicyclo[3.1.0]hex-3-yl]-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid Nombre IUPAC: 7-[(1R,5S)-6-amino-3-azabiciclo[3.1.0]hexan-3-il]-1-(2,4-difluorofenilo)-6-fluoro-4-oxo-1,8-naftiridina-3-carboxílico SMILES: N[C@@H]1[C@H]2CN(C[C@@H]12)c3nc4N(C=C(C(=O)O)C(=O)c4cc3F)c5ccc(F)cc5F

Sinónimo 7-((1R,5S,6s)-6-amino-3-azabicyclo[3.1.0]hexan-3-yl)-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-1,8-naphthyridine-3-carboxylic Acid,Turvel,3-Azabicyclo[3.1.0]hexane, 1,8-naphthyridine-3-carboxylic acid derivative,7-[(1alpha,5alpha,6alpha)-6-Amino-3-azabicyclo[3.1.0]hex-3-yl]-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid
Fórmula molecular C20H15F3N4O3
CAS 147059-72-1
Peso molecular (g/mol) 416.35
SMILES N[C@@H]1[C@H]2CN(C[C@@H]12)c3nc4N(C=C(C(=O)O)C(=O)c4cc3F)c5ccc(F)cc5F
Nombre IUPAC 7-[(1R,5S)-6-amino-3-azabiciclo[3.1.0]hexan-3-il]-1-(2,4-difluorofenilo)-6-fluoro-4-oxo-1,8-naftiridina-3-carboxílico
14

6-cloro-2-metoxiquinoxalina, TRC

CAS: 104152-39-8 Fórmula molecular: C9H7ClN2O Peso molecular (g/mol): 194.62 Sinónimo: 6-Chloro-2-methoxyquinoxaline Nombre IUPAC: 6-cloro-2-metoxiquinoxalina SMILES: COc1cnc2cc(Cl)ccc2n1

Sinónimo 6-Chloro-2-methoxyquinoxaline
Fórmula molecular C9H7ClN2O
CAS 104152-39-8
Peso molecular (g/mol) 194.62
SMILES COc1cnc2cc(Cl)ccc2n1
Nombre IUPAC 6-cloro-2-metoxiquinoxalina
15

Vandetanib, TRC

CAS: 443913-73-3 Fórmula molecular: C22 H24 Br F N4 O2 Peso molecular (g/mol): 475.35 Sinónimo: 4-Quinazolinamine, N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methyl-4-piperidinyl)methoxy]-,N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-[(1-methyl-4-piperidinyl)methoxy]-4-quinazolinamine,4-(4-Bromo-2-fluoroanilino)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazoline,CH 331,Caprelsa,N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-(N-methylpiperidin-4-ylmethoxy)quinazolin-4-amine,N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine,Vandetanib,ZD 6474,Zactima Nombre IUPAC: N-(4-bromo-2-fluorofenil)-6-metoxi-7-[(1-metilpiperidin-4-il)metoxi]quinazolin-4-amina SMILES: COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC4CCN(C)CC4

Sinónimo 4-Quinazolinamine, N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methyl-4-piperidinyl)methoxy]-,N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-[(1-methyl-4-piperidinyl)methoxy]-4-quinazolinamine,4-(4-Bromo-2-fluoroanilino)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazoline,CH 331,Caprelsa,N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-(N-methylpiperidin-4-ylmethoxy)quinazolin-4-amine,N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine,Vandetanib,ZD 6474,Zactima
Fórmula molecular C22 H24 Br F N4 O2
CAS 443913-73-3
Peso molecular (g/mol) 475.35
SMILES COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC4CCN(C)CC4
Nombre IUPAC N-(4-bromo-2-fluorofenil)-6-metoxi-7-[(1-metilpiperidin-4-il)metoxi]quinazolin-4-amina