4-pyrimidin-2-ylsulfanyl-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-pyrimidin-2-ylsulfanyl-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-pyrimidin-2-ylsulfanyl-2-(trifluoromethyl)benzonitrile CAS Name: 4-(2-pyrimidinylthio)-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-pyrimidin-2-ylsulfanyl-2-(trifluoromethyl)benzonitrile Traditional Name: 4-(2-pyrimidylthio)-2-(trifluoromethyl)benzonitrile Formula: C12H6F3N3S MolecularWeight: 281.25635

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SC2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

C1=CN=C(N=C1)SC2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C12H6F3N3S/c13-12(14,15)10-6-9(3-2-8(10)7-16)19-11-17-4-1-5-18-11/h1-6H