1-[(2-azanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide

Systemtic Name: 1-[(2-azanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide Openeye Name: 1-[(2-amino-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]cyclopropanecarboxamide CAS Name: 1-[[2-amino-5-cyano-6-(methylthio)-4-pyrimidinyl]amino]-N-[3-(trifluoromethyl)phenyl]-1-cyclopropanecarboxamide IUPAC Name: 1-[(2-amino-5-cyano-6-methylsulfanylpyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide Traditional Name: 1-[[2-amino-5-cyano-6-(methylthio)pyrimidin-4-yl]amino]-N-[3-(trifluoromethyl)phenyl]cyclopropanecarboxamide Formula: C17H15F3N6OS MolecularWeight: 408.40081

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)NC2(CC2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)N

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)NC2(CC2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)N

InChI

InChI=1S/C17H15F3N6OS/c1-28-13-11(8-21)12(24-15(22)25-13)26-16(5-6-16)14(27)23-10-4-2-3-9(7-10)17(18,19)20/h2-4,7H,5-6H2,1H3,(H,23,27)(H3,22,24,25,26)