(2S)-N-ethyl-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-ethyl-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: (2S)-2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-N-ethyl-propanamide CAS Name: (2S)-N-ethyl-2-[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: (2S)-2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-N-ethylpropanamide Traditional Name: (2S)-2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]-N-ethyl-propionamide Formula: C20H20F3N3OS MolecularWeight: 407.45251

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)SC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(F)(F)F

Isomeric SMILES

CCNC(=O)[C@H](C)SC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(F)(F)F

InChI

InChI=1S/C20H20F3N3OS/c1-3-24-18(27)13(2)28-19-25-16-11-15(20(21,22)23)9-10-17(16)26(19)12-14-7-5-4-6-8-14/h4-11,13H,3,12H2,1-2H3,(H,24,27)/t13-/m0/s1