N-[(2S)-3-oxidanyl-1-oxidanylidene-1-[[4-(trifluoromethyl)phenyl]methylamino]propan-2-yl]-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[(2S)-3-oxidanyl-1-oxidanylidene-1-[[4-(trifluoromethyl)phenyl]methylamino]propan-2-yl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-oxo-2-[[4-(trifluoromethyl)phenyl]methylamino]ethyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[(2S)-3-hydroxy-1-oxo-1-[[4-(trifluoromethyl)phenyl]methylamino]propan-2-yl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(2S)-3-hydroxy-1-oxo-1-[[4-(trifluoromethyl)phenyl]methylamino]propan-2-yl]-3H-benzimidazole-5-carboxamide Traditional Name: N-[(1S)-2-keto-1-methylol-2-[[4-(trifluoromethyl)benzyl]amino]ethyl]-3H-benzimidazole-5-carboxamide Formula: C19H17F3N4O3 MolecularWeight: 406.35849

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C(CO)NC(=O)C2=CC3=C(C=C2)N=CN3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)[C@H](CO)NC(=O)C2=CC3=C(C=C2)N=CN3)C(F)(F)F

InChI

InChI=1S/C19H17F3N4O3/c20-19(21,22)13-4-1-11(2-5-13)8-23-18(29)16(9-27)26-17(28)12-3-6-14-15(7-12)25-10-24-14/h1-7,10,16,27H,8-9H2,(H,23,29)(H,24,25)(H,26,28)/t16-/m0/s1