butyl 4-(3-chlorophenyl)-2-methyl-5-oxidanylidene-4,7-dihydro-1H-thieno[3,4-b]pyridine-3-carboxylate

Systemtic Name: butyl 4-(3-chlorophenyl)-2-methyl-5-oxidanylidene-4,7-dihydro-1H-thieno[3,4-b]pyridine-3-carboxylate Openeye Name: butyl 4-(3-chlorophenyl)-2-methyl-5-oxo-4,7-dihydro-1H-thieno[3,4-b]pyridine-3-carboxylate CAS Name: 4-(3-chlorophenyl)-2-methyl-5-oxo-4,7-dihydro-1H-thieno[3,4-b]pyridine-3-carboxylic acid butyl ester IUPAC Name: butyl 4-(3-chlorophenyl)-2-methyl-5-oxo-4,7-dihydro-1H-thieno[3,4-b]pyridine-3-carboxylate Traditional Name: 4-(3-chlorophenyl)-5-keto-2-methyl-4,7-dihydro-1H-thieno[3,4-b]pyridine-3-carboxylic acid butyl ester Formula: C19H20ClNO3S MolecularWeight: 377.885

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Cl)C(=O)SC2)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Cl)C(=O)SC2)C

InChI

InChI=1S/C19H20ClNO3S/c1-3-4-8-24-18(22)15-11(2)21-14-10-25-19(23)17(14)16(15)12-6-5-7-13(20)9-12/h5-7,9,16,21H,3-4,8,10H2,1-2H3