ethyl 2-azanyl-7-chloranyl-6-[(Z)-(pyridin-4-ylcarbonylhydrazinylidene)methyl]-4,5-dihydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-7-chloranyl-6-[(Z)-(pyridin-4-ylcarbonylhydrazinylidene)methyl]-4,5-dihydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-amino-7-chloro-6-[(Z)-(pyridine-4-carbonylhydrazono)methyl]-4,5-dihydrobenzothiophene-3-carboxylate CAS Name: 2-amino-7-chloro-6-[(Z)-[[oxo(pyridin-4-yl)methyl]hydrazinylidene]methyl]-4,5-dihydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-7-chloro-6-[(Z)-(pyridine-4-carbonylhydrazinylidene)methyl]-4,5-dihydro-1-benzothiophene-3-carboxylate Traditional Name: 2-amino-7-chloro-6-[(Z)-(isonicotinoylhydrazono)methyl]-4,5-dihydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C18H17ClN4O3S MolecularWeight: 404.87058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(=C2Cl)C=NNC(=O)C3=CC=NC=C3)N

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(=C2Cl)/C=N\NC(=O)C3=CC=NC=C3)N

InChI

InChI=1S/C18H17ClN4O3S/c1-2-26-18(25)13-12-4-3-11(14(19)15(12)27-16(13)20)9-22-23-17(24)10-5-7-21-8-6-10/h5-9H,2-4,20H2,1H3,(H,23,24)/b22-9-