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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CN2C(=O)CC(SC3=CC=CC=C32)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CN2C(=O)C[C@@H](SC3=CC=CC=C32)C

InChI

InChI=1S/C20H22N2O2S/c1-3-15-8-10-16(11-9-15)21-19(23)13-22-17-6-4-5-7-18(17)25-14(2)12-20(22)24/h4-11,14H,3,12-13H2,1-2H3,(H,21,23)/t14-/m0/s1