N-(2-ethyl-6-methyl-phenyl)-2-methylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-methylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-methylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-(methylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-methylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-(methylthio)-4-(trifluoromethyl)pyrimidine-5-carboxamide Formula: C16H16F3N3OS MolecularWeight: 355.37795

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CN=C(N=C2C(F)(F)F)SC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CN=C(N=C2C(F)(F)F)SC)C

InChI

InChI=1S/C16H16F3N3OS/c1-4-10-7-5-6-9(2)12(10)21-14(23)11-8-20-15(24-3)22-13(11)16(17,18)19/h5-8H,4H2,1-3H3,(H,21,23)