(2S)-N-(ethylcarbamoyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-2-phenyl-ethanamide

Systemtic Name: (2S)-N-(ethylcarbamoyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-2-phenyl-ethanamide Openeye Name: (2S)-N-(ethylcarbamoyl)-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-2-phenyl-acetamide CAS Name: (2S)-N-(ethylcarbamoyl)-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]-2-phenylacetamide IUPAC Name: (2S)-N-(ethylcarbamoyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-2-phenylacetamide Traditional Name: (2S)-N-(ethylcarbamoyl)-2-[(1-isobutylbenzimidazol-2-yl)thio]-2-phenyl-acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C1=CC=CC=C1)SC2=NC3=CC=CC=C3N2CC(C)C

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C1=CC=CC=C1)SC2=NC3=CC=CC=C3N2CC(C)C

InChI

InChI=1S/C22H26N4O2S/c1-4-23-21(28)25-20(27)19(16-10-6-5-7-11-16)29-22-24-17-12-8-9-13-18(17)26(22)14-15(2)3/h5-13,15,19H,4,14H2,1-3H3,(H2,23,25,27,28)/t19-/m0/s1