2-methylsulfanyl-4-(trifluoromethyl)-N-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide

Systemtic Name: 2-methylsulfanyl-4-(trifluoromethyl)-N-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide Openeye Name: 2-methylsulfanyl-4-(trifluoromethyl)-N-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide CAS Name: 2-(methylthio)-4-(trifluoromethyl)-N-(2,4,6-trimethylphenyl)-5-pyrimidinecarboxamide IUPAC Name: 2-methylsulfanyl-4-(trifluoromethyl)-N-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide Traditional Name: N-mesityl-2-(methylthio)-4-(trifluoromethyl)pyrimidine-5-carboxamide Formula: C16H16F3N3OS MolecularWeight: 355.37795

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=CN=C(N=C2C(F)(F)F)SC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CN=C(N=C2C(F)(F)F)SC)C

InChI

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