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

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-2-(2,2-dimethyl-4-oxidanylidene-3H-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)acetamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-2-(4-keto-2,2-dimethyl-3H-1,5-benzothiazepin-5-yl)acetamide Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCCC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1(CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCCC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H23ClN2O2S/c1-21(2)13-20(26)24(17-5-3-4-6-18(17)27-21)14-19(25)23-12-11-15-7-9-16(22)10-8-15/h3-10H,11-14H2,1-2H3,(H,23,25)