2-methyl-4-methylsulfanyl-6-[[3-(trifluoromethyl)phenyl]amino]pyrimidine-5-carbonitrile

Systemtic Name: 2-methyl-4-methylsulfanyl-6-[[3-(trifluoromethyl)phenyl]amino]pyrimidine-5-carbonitrile Openeye Name: 2-methyl-4-methylsulfanyl-6-[3-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile CAS Name: 2-methyl-4-(methylthio)-6-[3-(trifluoromethyl)anilino]-5-pyrimidinecarbonitrile IUPAC Name: 2-methyl-4-methylsulfanyl-6-[3-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile Traditional Name: 2-methyl-4-(methylthio)-6-[3-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile Formula: C14H11F3N4S MolecularWeight: 324.32415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)SC)C#N)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC1=NC(=C(C(=N1)SC)C#N)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H11F3N4S/c1-8-19-12(11(7-18)13(20-8)22-2)21-10-5-3-4-9(6-10)14(15,16)17/h3-6H,1-2H3,(H,19,20,21)