4-oxidanylidene-N-(3-propan-2-ylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-(3-propan-2-ylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(3-isopropylphenyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-(3-propan-2-ylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-(3-propan-2-ylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-m-cumenyl-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3

InChI

InChI=1S/C19H20N2O2S/c1-12(2)13-4-3-5-15(10-13)20-19(23)14-6-7-17-16(11-14)21-18(22)8-9-24-17/h3-7,10-12H,8-9H2,1-2H3,(H,20,23)(H,21,22)