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

Systemtic Name: 2-(2-azanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)sulfanyl-N-[4-fluoranyl-3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(2-amino-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)sulfanyl-N-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[2-amino-5-cyano-6-(methylthio)-4-pyrimidinyl]thio]-N-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(2-amino-5-cyano-6-methylsulfanylpyrimidin-4-yl)sulfanyl-N-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[2-amino-5-cyano-6-(methylthio)pyrimidin-4-yl]thio]-N-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide Formula: C15H11F4N5OS2 MolecularWeight: 417.404353

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=NC(=N1)N)SCC(=O)NC2=CC(=C(C=C2)F)C(F)(F)F)C#N

Isomeric SMILES

CSC1=C(C(=NC(=N1)N)SCC(=O)NC2=CC(=C(C=C2)F)C(F)(F)F)C#N

InChI

InChI=1S/C15H11F4N5OS2/c1-26-12-8(5-20)13(24-14(21)23-12)27-6-11(25)22-7-2-3-10(16)9(4-7)15(17,18)19/h2-4H,6H2,1H3,(H,22,25)(H2,21,23,24)