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

Systemtic Name: 2-(2-azanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)sulfanyl-N-methyl-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(2-amino-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)sulfanyl-N-methyl-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[2-amino-5-cyano-6-(methylthio)-4-pyrimidinyl]thio]-N-methyl-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(2-amino-5-cyano-6-methylsulfanylpyrimidin-4-yl)sulfanyl-N-methyl-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[2-amino-5-cyano-6-(methylthio)pyrimidin-4-yl]thio]-N-methyl-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C16H14F3N5OS2 MolecularWeight: 413.44047

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC(=C1)C(F)(F)F)C(=O)CSC2=NC(=NC(=C2C#N)SC)N

Isomeric SMILES

CN(C1=CC=CC(=C1)C(F)(F)F)C(=O)CSC2=NC(=NC(=C2C#N)SC)N

InChI

InChI=1S/C16H14F3N5OS2/c1-24(10-5-3-4-9(6-10)16(17,18)19)12(25)8-27-14-11(7-20)13(26-2)22-15(21)23-14/h3-6H,8H2,1-2H3,(H2,21,22,23)