N-[4-(3,5-dihydro-2H-4,1-benzothiazepin-1-ylcarbonyl)phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-(3,5-dihydro-2H-4,1-benzothiazepin-1-ylcarbonyl)phenyl]-2-methyl-benzamide Openeye Name: N-[4-(3,5-dihydro-2H-4,1-benzothiazepine-1-carbonyl)phenyl]-2-methyl-benzamide CAS Name: N-[4-[3,5-dihydro-2H-4,1-benzothiazepin-1-yl(oxo)methyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-(3,5-dihydro-2H-4,1-benzothiazepine-1-carbonyl)phenyl]-2-methylbenzamide Traditional Name: N-[4-(3,5-dihydro-2H-4,1-benzothiazepine-1-carbonyl)phenyl]-2-methyl-benzamide Formula: C24H22N2O2S MolecularWeight: 402.50868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3CCSCC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3CCSCC4=CC=CC=C43

InChI

InChI=1S/C24H22N2O2S/c1-17-6-2-4-8-21(17)23(27)25-20-12-10-18(11-13-20)24(28)26-14-15-29-16-19-7-3-5-9-22(19)26/h2-13H,14-16H2,1H3,(H,25,27)