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

Systemtic Name: 4-methylsulfanyl-2-phenyl-6-[[4-(trifluoromethyl)phenyl]amino]pyrimidine-5-carbonitrile Openeye Name: 4-methylsulfanyl-2-phenyl-6-[4-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile CAS Name: 4-(methylthio)-2-phenyl-6-[4-(trifluoromethyl)anilino]-5-pyrimidinecarbonitrile IUPAC Name: 4-methylsulfanyl-2-phenyl-6-[4-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile Traditional Name: 4-(methylthio)-2-phenyl-6-[4-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile Formula: C19H13F3N4S MolecularWeight: 386.39353

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)NC2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)NC2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C19H13F3N4S/c1-27-18-15(11-23)17(25-16(26-18)12-5-3-2-4-6-12)24-14-9-7-13(8-10-14)19(20,21)22/h2-10H,1H3,(H,24,25,26)