N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)-2-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C21H17F3N4OS2 MolecularWeight: 462.51109

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3)C

InChI

InChI=1S/C21H17F3N4OS2/c1-3-14-12(2)31-19(15(14)10-25)28-18(29)11-30-20-26-16(13-7-5-4-6-8-13)9-17(27-20)21(22,23)24/h4-9H,3,11H2,1-2H3,(H,28,29)