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

Systemtic Name: N-[4-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylcarbonyl)phenyl]-2-methyl-benzamide Openeye Name: N-[4-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)phenyl]-2-methyl-benzamide CAS Name: N-[4-[3,4-dihydro-2H-1,5-benzothiazepin-5-yl(oxo)methyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)phenyl]-2-methylbenzamide Traditional Name: N-[4-(3,4-dihydro-2H-1,5-benzothiazepine-5-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)N3CCCSC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3CCCSC4=CC=CC=C43

InChI

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