4-methylsulfanyl-2-pyridin-3-yl-6-[4-(trifluoromethyloxy)phenyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-methylsulfanyl-2-pyridin-3-yl-6-[4-(trifluoromethyloxy)phenyl]pyrimidine-5-carbonitrile Openeye Name: 4-methylsulfanyl-2-(3-pyridyl)-6-[4-(trifluoromethoxy)phenyl]pyrimidine-5-carbonitrile CAS Name: 4-(methylthio)-2-(3-pyridinyl)-6-[4-(trifluoromethoxy)phenyl]-5-pyrimidinecarbonitrile IUPAC Name: 4-methylsulfanyl-2-pyridin-3-yl-6-[4-(trifluoromethoxy)phenyl]pyrimidine-5-carbonitrile Traditional Name: 4-(methylthio)-2-(3-pyridyl)-6-[4-(trifluoromethoxy)phenyl]pyrimidine-5-carbonitrile Formula: C18H11F3N4OS MolecularWeight: 388.36635

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H11F3N4OS/c1-27-17-14(9-22)15(24-16(25-17)12-3-2-8-23-10-12)11-4-6-13(7-5-11)26-18(19,20)21/h2-8,10H,1H3