N-(3,5-dimethylphenyl)-2-[(2R)-4-oxidanylidene-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-[(2R)-4-oxidanylidene-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide CAS Name: N-(3,5-dimethylphenyl)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide Traditional Name: N-(3,5-dimethylphenyl)-2-[(2R)-4-keto-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide Formula: C25H24N2O2S MolecularWeight: 416.53526

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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)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CN2C(=O)C[C@@H](SC3=CC=CC=C32)C4=CC=CC=C4)C

InChI

InChI=1S/C25H24N2O2S/c1-17-12-18(2)14-20(13-17)26-24(28)16-27-21-10-6-7-11-22(21)30-23(15-25(27)29)19-8-4-3-5-9-19/h3-14,23H,15-16H2,1-2H3,(H,26,28)/t23-/m1/s1