N-(3-methylphenyl)-2-(4-oxidanylidene-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-(3-methylphenyl)-2-(4-oxidanylidene-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-(m-tolyl)-2-(4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-(3-methylphenyl)-2-(4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-(3-methylphenyl)-2-(4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide Traditional Name: 2-(4-keto-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)-N-(m-tolyl)acetamide Formula: C24H22N2O2S MolecularWeight: 402.50868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CN2C(=O)CC(SC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CN2C(=O)CC(SC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O2S/c1-17-8-7-11-19(14-17)25-23(27)16-26-20-12-5-6-13-21(20)29-22(15-24(26)28)18-9-3-2-4-10-18/h2-14,22H,15-16H2,1H3,(H,25,27)