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

Systemtic Name: N-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-(4-methylphenyl)-3-oxidanylidene-propyl]ethanamide Openeye Name: N-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxo-1-(p-tolyl)propyl]acetamide CAS Name: N-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-(4-methylphenyl)-3-oxopropyl]acetamide IUPAC Name: N-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-(4-methylphenyl)-3-oxopropyl]acetamide Traditional Name: N-[3-keto-3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-(p-tolyl)propyl]acetamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CC(C3=CC=C(C=C3)C)NC(=O)C

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CC(C3=CC=C(C=C3)C)NC(=O)C

InChI

InChI=1S/C22H26N2O2S/c1-15-8-10-18(11-9-15)19(23-17(3)25)14-22(26)24-13-12-16(2)27-21-7-5-4-6-20(21)24/h4-11,16,19H,12-14H2,1-3H3,(H,23,25)