2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide Openeye Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethyl]sulfanyl-N-(m-tolyl)acetamide CAS Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]sulfanyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-keto-ethyl]thio]-N-(m-tolyl)acetamide Formula: C20H22N2O2S2 MolecularWeight: 386.53088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCCSC3=CC=CC=C32

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCCSC3=CC=CC=C32

InChI

InChI=1S/C20H22N2O2S2/c1-15-6-4-7-16(12-15)21-19(23)13-25-14-20(24)22-10-5-11-26-18-9-3-2-8-17(18)22/h2-4,6-9,12H,5,10-11,13-14H2,1H3,(H,21,23)