N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(5-ethanoyl-2-methoxy-phenyl)ethanamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(5-ethanoyl-2-methoxy-phenyl)ethanamide Openeye Name: 2-(5-acetyl-2-methoxy-phenyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]acetamide CAS Name: 2-(5-acetyl-2-methoxyphenyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]acetamide IUPAC Name: 2-(5-acetyl-2-methoxyphenyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]acetamide Traditional Name: 2-(5-acetyl-2-methoxy-phenyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]acetamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)N[C@@H](CCSC)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C22H25N3O3S/c1-14(26)15-8-9-20(28-2)16(12-15)13-21(27)23-19(10-11-29-3)22-24-17-6-4-5-7-18(17)25-22/h4-9,12,19H,10-11,13H2,1-3H3,(H,23,27)(H,24,25)/t19-/m0/s1