ethyl 5-oxidanylidene-3-phenyl-7-phenylazanyl-4H-1,4-thiazepine-6-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-3-phenyl-7-phenylazanyl-4H-1,4-thiazepine-6-carboxylate Openeye Name: ethyl 7-anilino-5-oxo-3-phenyl-4H-1,4-thiazepine-6-carboxylate CAS Name: 7-anilino-5-oxo-3-phenyl-4H-1,4-thiazepine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 7-anilino-5-oxo-3-phenyl-4H-1,4-thiazepine-6-carboxylate Traditional Name: 7-anilino-5-keto-3-phenyl-4H-1,4-thiazepine-6-carboxylic acid ethyl ester Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C(NC1=O)C2=CC=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C(NC1=O)C2=CC=CC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O3S/c1-2-25-20(24)17-18(23)22-16(14-9-5-3-6-10-14)13-26-19(17)21-15-11-7-4-8-12-15/h3-13,21H,2H2,1H3,(H,22,23)