2-(1-ethylbenzimidazol-2-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethylcarbamoyl]propanamide

Systemtic Name: 2-(1-ethylbenzimidazol-2-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethylcarbamoyl]propanamide Openeye Name: 2-(1-ethylbenzimidazol-2-yl)sulfanyl-N-(2,2,2-trifluoroethylcarbamoyl)propanamide CAS Name: 2-[(1-ethyl-2-benzimidazolyl)thio]-N-[oxo-(2,2,2-trifluoroethylamino)methyl]propanamide IUPAC Name: 2-(1-ethylbenzimidazol-2-yl)sulfanyl-N-(2,2,2-trifluoroethylcarbamoyl)propanamide Traditional Name: 2-[(1-ethylbenzimidazol-2-yl)thio]-N-(2,2,2-trifluoroethylcarbamoyl)propionamide Formula: C15H17F3N4O2S MolecularWeight: 374.38129

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)NC(=O)NCC(F)(F)F

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)NC(=O)NCC(F)(F)F

InChI

InChI=1S/C15H17F3N4O2S/c1-3-22-11-7-5-4-6-10(11)20-14(22)25-9(2)12(23)21-13(24)19-8-15(16,17)18/h4-7,9H,3,8H2,1-2H3,(H2,19,21,23,24)