(2R)-N-aminocarbonyl-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: (2R)-2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-N-carbamoyl-propanamide CAS Name: (2R)-N-carbamoyl-2-[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: (2R)-2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-N-carbamoylpropanamide Traditional Name: (2R)-2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]-N-carbamoyl-propionamide Formula: C19H17F3N4O2S MolecularWeight: 422.42409

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17F3N4O2S/c1-11(16(27)25-17(23)28)29-18-24-14-9-13(19(20,21)22)7-8-15(14)26(18)10-12-5-3-2-4-6-12/h2-9,11H,10H2,1H3,(H3,23,25,27,28)/t11-/m1/s1