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

Systemtic Name: 2-(2,2-dimethyl-4-oxidanylidene-3H-1,5-benzothiazepin-5-yl)-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-(4-keto-2,2-dimethyl-3H-1,5-benzothiazepin-5-yl)-N-p-anisyl-acetamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1(CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H24N2O3S/c1-21(2)12-20(25)23(17-6-4-5-7-18(17)27-21)14-19(24)22-13-15-8-10-16(26-3)11-9-15/h4-11H,12-14H2,1-3H3,(H,22,24)