2-[(2S)-2-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(2S)-2-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenethyl-ethanamide Openeye Name: 2-[(2S)-2-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenethyl-acetamide CAS Name: 2-[(2S)-2-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenethylacetamide IUPAC Name: 2-[(2S)-2-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenethylacetamide Traditional Name: 2-[(2S)-4-keto-2-methyl-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenethyl-acetamide Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2S/c1-15-13-20(24)22(17-9-5-6-10-18(17)25-15)14-19(23)21-12-11-16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3,(H,21,23)/t15-/m0/s1