4-oxidanylidene-N-[(2S)-2-phenylpropyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-[(2S)-2-phenylpropyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-[(2S)-2-phenylpropyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-[(2S)-2-phenylpropyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-[(2S)-2-phenylpropyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-[(2S)-2-phenylpropyl]-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(CNC(=O)C1=CC2=C(C=C1)SCCC(=O)N2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)C1=CC2=C(C=C1)SCCC(=O)N2)C3=CC=CC=C3

InChI

InChI=1S/C19H20N2O2S/c1-13(14-5-3-2-4-6-14)12-20-19(23)15-7-8-17-16(11-15)21-18(22)9-10-24-17/h2-8,11,13H,9-10,12H2,1H3,(H,20,23)(H,21,22)/t13-/m1/s1