4-fluoranyl-6-(phenylmethylsulfanyl)-2-(trifluoromethyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-fluoranyl-6-(phenylmethylsulfanyl)-2-(trifluoromethyl)pyrimidine-5-carbonitrile Openeye Name: 4-benzylsulfanyl-6-fluoro-2-(trifluoromethyl)pyrimidine-5-carbonitrile CAS Name: 4-fluoro-6-(phenylmethylthio)-2-(trifluoromethyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-benzylsulfanyl-6-fluoro-2-(trifluoromethyl)pyrimidine-5-carbonitrile Traditional Name: 4-(benzylthio)-6-fluoro-2-(trifluoromethyl)pyrimidine-5-carbonitrile Formula: C13H7F4N3S MolecularWeight: 313.273393

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=NC(=C2C#N)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=NC(=C2C#N)F)C(F)(F)F

InChI

InChI=1S/C13H7F4N3S/c14-10-9(6-18)11(20-12(19-10)13(15,16)17)21-7-8-4-2-1-3-5-8/h1-5H,7H2