N-[2-(cyanomethylsulfanyl)phenyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C15H11F3N4OS2 MolecularWeight: 384.39925

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F)SCC#N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F)SCC#N

InChI

InChI=1S/C15H11F3N4OS2/c16-15(17,18)12-5-7-20-14(22-12)25-9-13(23)21-10-3-1-2-4-11(10)24-8-6-19/h1-5,7H,8-9H2,(H,21,23)