CAS RN: 37126-45-7
CAS Name: (5E)-5-(dimethylaminohydrazinylidene)-2-phenyl-4-imidazolecarboxylic acid ethyl ester
OPENEYE Name: ethyl (5E)-5-(dimethylaminohydrazono)-2-phenyl-imidazole-4-carboxylate
IUPAC Name: ethyl (5E)-5-(dimethylaminohydrazinylidene)-2-phenylimidazole-4-carboxylate
SYSTEMATIC NAME: ethyl (5E)-5-(dimethylaminohydrazinylidene)-2-phenyl-imidazole-4-carboxylate
MOLECULAR FORMULA: C14H17N5O2
MOLECULAR WEIGHT: 287.31708
SMILES: CCOC(=O)C\1=NC(=N/C1=N/NN(C)C)C2=CC=CC=C2
Structure:
CAS RN: 28177-14-2
CAS Name: (5Z)-5-[(2-chloroethylamino)hydrazinylidene]-4-imidazolecarboxamide
OPENEYE Name: (5Z)-5-[(2-chloroethylamino)hydrazono]imidazole-4-carboxamide
IUPAC Name: (5Z)-5-[(2-chloroethylamino)hydrazinylidene]imidazole-4-carboxamide
SYSTEMATIC NAME: (5Z)-5-[(2-chloroethylamino)hydrazinylidene]imidazole-4-carboxamide
MOLECULAR FORMULA: C6H9ClN6O
MOLECULAR WEIGHT: 216.62826
SMILES: C1=N/C(=N\NNCCCl)/C(=N1)C(=O)N
Structure:
CAS RN: 126663-39-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C38H50Cl2N2O4
MOLECULAR WEIGHT: 669.7206
SMILES: CC1[C@@H]2CC3=C([C@]1(CCN2CC=C(C)C)C)C=C(C=C3)O.C=CCN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3C(=O)CC4.Cl.Cl
Structure:
CAS RN: 57-29-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H22ClNO3
MOLECULAR WEIGHT: 347.83588
SMILES: C=CCN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O.Cl
Structure:
CAS RN: 49608-51-7
CAS Name: (2Z)-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-4-thiazolidinecarboxylic acid
OPENEYE Name: (2Z)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)thiazolidine-4-carboxylic acid
IUPAC Name: (2Z)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidine-4-carboxylic acid
SYSTEMATIC NAME: (2Z)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidine-4-carboxylic acid
MOLECULAR FORMULA: C10H9NO3S
MOLECULAR WEIGHT: 223.24836
SMILES: C1C(N/C(=C/2\C=CC=CC2=O)/S1)C(=O)O
Structure:
CAS RN: 61094-63-1
CAS Name: (4Z)-4-[ethoxy(hydroxy)methylidene]-2,3-dioxo-1-cyclopentanecarboxylic acid ethyl ester
OPENEYE Name: ethyl (4Z)-4-[ethoxy(hydroxy)methylene]-2,3-dioxo-cyclopentanecarboxylate
IUPAC Name: ethyl (4Z)-4-[ethoxy(hydroxy)methylidene]-2,3-dioxocyclopentane-1-carboxylate
SYSTEMATIC NAME: ethyl (4Z)-4-[ethoxy(oxidanyl)methylidene]-2,3-bis(oxidanylidene)cyclopentane-1-carboxylate
MOLECULAR FORMULA: C11H14O6
MOLECULAR WEIGHT: 242.22526
SMILES: CCOC(=O)C1C/C(=C(\O)/OCC)/C(=O)C1=O
Structure:
CAS RN: 19403-80-6
CAS Name: (6E)-6-[(1-phenylethylamino)methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-6-[(1-phenylethylamino)methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-6-[(1-phenylethylamino)methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-6-[(1-phenylethylamino)methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C15H15NO
MOLECULAR WEIGHT: 225.2857
SMILES: CC(C1=CC=CC=C1)N/C=C/2\C=CC=CC2=O
Structure:
CAS RN: 33215-63-3
CAS Name: (6E)-4-chloro-6-[[(3-chlorophenyl)methoxyamino]methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-4-chloro-6-[[(3-chlorophenyl)methoxyamino]methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-4-chloro-6-[[(3-chlorophenyl)methoxyamino]methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-4-chloranyl-6-[[(3-chlorophenyl)methoxyamino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H11Cl2NO2
MOLECULAR WEIGHT: 296.14864
SMILES: C1=CC(=CC(=C1)Cl)CON/C=C/2\C=C(C=CC2=O)Cl
Structure:
CAS RN: 894-93-9
CAS Name: (1E)-1-[(2-hydroxyanilino)methylidene]-2-naphthalenone
OPENEYE Name: (1E)-1-[(2-hydroxyanilino)methylene]naphthalen-2-one
IUPAC Name: (1E)-1-[(2-hydroxyanilino)methylidene]naphthalen-2-one
SYSTEMATIC NAME: (1E)-1-[[(2-hydroxyphenyl)amino]methylidene]naphthalen-2-one
MOLECULAR FORMULA: C17H13NO2
MOLECULAR WEIGHT: 263.29062
SMILES: C1=CC=C\2C(=C1)C=CC(=O)/C2=C/NC3=CC=CC=C3O
Structure:
CAS RN: 73332-87-3
CAS Name: 2-amino-9-fluorenone oxime
OPENEYE Name: 2-aminofluoren-9-one oxime
IUPAC Name: (NZ)-N-(2-aminofluoren-9-ylidene)hydroxylamine
SYSTEMATIC NAME: (NZ)-N-(2-azanylfluoren-9-ylidene)hydroxylamine
MOLECULAR FORMULA: C13H10N2O
MOLECULAR WEIGHT: 210.2313
SMILES: C1=CC=C\2C(=C1)C3=C(/C2=N\O)C=C(C=C3)N
Structure:
CAS RN: 1332-94-1
CAS Name: (2S,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid
OPENEYE Name: (2S,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
IUPAC Name: (2S,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
MOLECULAR FORMULA: C14H15NO7
MOLECULAR WEIGHT: 309.2714
SMILES: C1=CC=C(C=C1)[C@H](C#N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O
Structure:
CAS RN: 57534-26-6
CAS Name: (2S,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid
OPENEYE Name: (2S,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
IUPAC Name: (2S,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
MOLECULAR FORMULA: C14H15NO7
MOLECULAR WEIGHT: 309.2714
SMILES: C1=CC=C(C=C1)[C@H](C#N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O
Structure:
CAS RN: 1948-31-8
CAS Name: (2S)-2-[[(2S)-2-amino-1-oxopropyl]amino]propanoic acid
OPENEYE Name: (2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoic acid
IUPAC Name: (2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoic acid
SYSTEMATIC NAME: (2S)-2-[[(2S)-2-azanylpropanoyl]amino]propanoic acid
MOLECULAR FORMULA: C6H12N2O3
MOLECULAR WEIGHT: 160.17108
SMILES: C[C@@H](C(=O)N[C@@H](C)C(=O)O)N
Structure:
CAS RN: 5659-09-6
CAS Name: (5E)-5-[(2-quinolinylhydrazo)methylidene]-8-quinolinone
OPENEYE Name: (5E)-5-[[2-(2-quinolyl)hydrazino]methylene]quinolin-8-one
IUPAC Name: (5E)-5-[(2-quinolin-2-ylhydrazinyl)methylidene]quinolin-8-one
SYSTEMATIC NAME: (5E)-5-[(2-quinolin-2-ylhydrazinyl)methylidene]quinolin-8-one
MOLECULAR FORMULA: C19H14N4O
MOLECULAR WEIGHT: 314.34066
SMILES: C1=CC=C2C(=C1)C=CC(=N2)NN/C=C/3\C=CC(=O)C4=C3C=CC=N4
Structure:
CAS RN: 16987-32-9
CAS Name: (6Z)-6-[(1-azepanylamino)methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: (6Z)-6-[(azepan-1-ylamino)methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: (6Z)-6-[(azepan-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-6-[(azepan-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C13H18N2O
MOLECULAR WEIGHT: 218.29482
SMILES: C1CCCN(CC1)N/C=C\2/C=CC=CC2=O
Structure:
CAS RN: 93982-60-6
CAS Name: N-[(E)-3-indolylidenemethyl]cyclohexanamine
OPENEYE Name: N-[(E)-indol-3-ylidenemethyl]cyclohexanamine
IUPAC Name: N-[(E)-indol-3-ylidenemethyl]cyclohexanamine
SYSTEMATIC NAME: N-[(E)-indol-3-ylidenemethyl]cyclohexanamine
MOLECULAR FORMULA: C15H18N2
MOLECULAR WEIGHT: 226.31682
SMILES: C1CCC(CC1)N/C=C\2/C=NC3=CC=CC=C32
Structure:
CAS RN: 10418-09-4
CAS Name: (2Z)-2-(carbamothioylhydrazinylidene)propanoic acid
OPENEYE Name: (2Z)-2-(carbamothioylhydrazono)propanoic acid
IUPAC Name: (2Z)-2-(carbamothioylhydrazinylidene)propanoic acid
SYSTEMATIC NAME: (2Z)-2-(carbamothioylhydrazinylidene)propanoic acid
MOLECULAR FORMULA: C4H7N3O2S
MOLECULAR WEIGHT: 161.18228
SMILES: C/C(=N/NC(=S)N)/C(=O)O
Structure:
CAS RN: 2169-99-5
CAS Name: (6E)-6-[(hydroxyamino)methylidene]-2-methoxy-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-6-[(hydroxyamino)methylene]-2-methoxy-cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-6-[(hydroxyamino)methylidene]-2-methoxycyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-2-methoxy-6-[(oxidanylamino)methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C8H9NO3
MOLECULAR WEIGHT: 167.16196
SMILES: COC1=CC=C/C(=C\NO)/C1=O
Structure:
CAS RN: 82499-15-8
CAS Name: N-propyl-7H-purine-6-sulfonamide
OPENEYE Name: N-propyl-7H-purine-6-sulfonamide
IUPAC Name: N-propyl-7H-purine-6-sulfonamide
SYSTEMATIC NAME: N-propyl-7H-purine-6-sulfonamide
MOLECULAR FORMULA: C8H11N5O2S
MOLECULAR WEIGHT: 241.27024
SMILES: CCCNS(=O)(=O)C1=NC=NC2=C1NC=N2
Structure:
CAS RN: 82499-18-1
CAS Name: N-(2-ethoxyethyl)-7H-purine-6-sulfonamide
OPENEYE Name: N-(2-ethoxyethyl)-7H-purine-6-sulfonamide
IUPAC Name: N-(2-ethoxyethyl)-7H-purine-6-sulfonamide
SYSTEMATIC NAME: N-(2-ethoxyethyl)-7H-purine-6-sulfonamide
MOLECULAR FORMULA: C9H13N5O3S
MOLECULAR WEIGHT: 271.29622
SMILES: CCOCCNS(=O)(=O)C1=NC=NC2=C1NC=N2
Structure:
CAS RN: 82499-19-2
CAS Name: N-(phenylmethyl)-7H-purine-6-sulfonamide
OPENEYE Name: N-benzyl-7H-purine-6-sulfonamide
IUPAC Name: N-benzyl-7H-purine-6-sulfonamide
SYSTEMATIC NAME: N-(phenylmethyl)-7H-purine-6-sulfonamide
MOLECULAR FORMULA: C12H11N5O2S
MOLECULAR WEIGHT: 289.31304
SMILES: C1=CC=C(C=C1)CNS(=O)(=O)C2=NC=NC3=C2NC=N3
Structure:
CAS RN: 82499-16-9
CAS Name: N-(2-methylpropyl)-7H-purine-6-sulfonamide
OPENEYE Name: N-isobutyl-7H-purine-6-sulfonamide
IUPAC Name: N-(2-methylpropyl)-7H-purine-6-sulfonamide
SYSTEMATIC NAME: N-(2-methylpropyl)-7H-purine-6-sulfonamide
MOLECULAR FORMULA: C9H13N5O2S
MOLECULAR WEIGHT: 255.29682
SMILES: CC(C)CNS(=O)(=O)C1=NC=NC2=C1NC=N2
Structure:
CAS RN: 82499-17-0
CAS Name: N-(3-methoxypropyl)-7H-purine-6-sulfonamide
OPENEYE Name: N-(3-methoxypropyl)-7H-purine-6-sulfonamide
IUPAC Name: N-(3-methoxypropyl)-7H-purine-6-sulfonamide
SYSTEMATIC NAME: N-(3-methoxypropyl)-7H-purine-6-sulfonamide
MOLECULAR FORMULA: C9H13N5O3S
MOLECULAR WEIGHT: 271.29622
SMILES: COCCCNS(=O)(=O)C1=NC=NC2=C1NC=N2
Structure:
CAS RN: 2089-32-9
CAS Name: 1-(4-ethylphenyl)ethanone oxime
OPENEYE Name: 1-(4-ethylphenyl)ethanone oxime
IUPAC Name: (NE)-N-[1-(4-ethylphenyl)ethylidene]hydroxylamine
SYSTEMATIC NAME: (NE)-N-[1-(4-ethylphenyl)ethylidene]hydroxylamine
MOLECULAR FORMULA: C10H13NO
MOLECULAR WEIGHT: 163.21632
SMILES: CCC1=CC=C(C=C1)/C(=N/O)/C
Structure:
CAS RN: 82499-14-7
CAS Name: N-methyl-7H-purine-6-sulfonamide
OPENEYE Name: N-methyl-7H-purine-6-sulfonamide
IUPAC Name: N-methyl-7H-purine-6-sulfonamide
SYSTEMATIC NAME: N-methyl-7H-purine-6-sulfonamide
MOLECULAR FORMULA: C6H7N5O2S
MOLECULAR WEIGHT: 213.21708
SMILES: CNS(=O)(=O)C1=NC=NC2=C1NC=N2
Structure:
CAS RN: 28058-30-2
CAS Name: (6E)-4-bromo-6-[[(5-nitro-2-pyridinyl)hydrazo]methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-4-bromo-6-[[2-(5-nitro-2-pyridyl)hydrazino]methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-4-bromo-6-[[2-(5-nitropyridin-2-yl)hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-4-bromanyl-6-[[2-(5-nitropyridin-2-yl)hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C12H9BrN4O3
MOLECULAR WEIGHT: 337.12886
SMILES: C1=CC(=O)/C(=C/NNC2=NC=C(C=C2)[N+](=O)[O-])/C=C1Br
Structure:
CAS RN: 28058-39-1
CAS Name: (4E)-2-ethoxy-4-[[(5-nitro-2-pyridinyl)hydrazo]methylidene]-1-cyclohexa-2,5-dienone
OPENEYE Name: (4E)-2-ethoxy-4-[[2-(5-nitro-2-pyridyl)hydrazino]methylene]cyclohexa-2,5-dien-1-one
IUPAC Name: (4E)-2-ethoxy-4-[[2-(5-nitropyridin-2-yl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: (4E)-2-ethoxy-4-[[2-(5-nitropyridin-2-yl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C14H14N4O4
MOLECULAR WEIGHT: 302.28536
SMILES: CCOC1=C/C(=C/NNC2=NC=C(C=C2)[N+](=O)[O-])/C=CC1=O
Structure:
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