N-(3-methylbutylcarbamoyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-methylbutylcarbamoyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(isopentylcarbamoyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[(3-methylbutylamino)-oxomethyl]-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(3-methylbutylcarbamoyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(isoamylcarbamoyl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C13H17F3N4O2S MolecularWeight: 350.35989

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NC=CC(=N1)C(F)(F)F

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NC=CC(=N1)C(F)(F)F

InChI

InChI=1S/C13H17F3N4O2S/c1-8(2)3-5-17-11(22)20-10(21)7-23-12-18-6-4-9(19-12)13(14,15)16/h4,6,8H,3,5,7H2,1-2H3,(H2,17,20,21,22)