2-(2,2-dimethyl-4-oxidanylidene-3H-1,5-benzothiazepin-5-yl)-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-(2,2-dimethyl-4-oxidanylidene-3H-1,5-benzothiazepin-5-yl)-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)-N-(p-tolylmethyl)acetamide CAS Name: 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-(4-keto-2,2-dimethyl-3H-1,5-benzothiazepin-5-yl)-N-(4-methylbenzyl)acetamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CN2C(=O)CC(SC3=CC=CC=C32)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CN2C(=O)CC(SC3=CC=CC=C32)(C)C

InChI

InChI=1S/C21H24N2O2S/c1-15-8-10-16(11-9-15)13-22-19(24)14-23-17-6-4-5-7-18(17)26-21(2,3)12-20(23)25/h4-11H,12-14H2,1-3H3,(H,22,24)