4-phenyl-2-(phenylmethylsulfanyl)-6-(trifluoromethyl)pyrimidine

Systemtic Name: 4-phenyl-2-(phenylmethylsulfanyl)-6-(trifluoromethyl)pyrimidine Openeye Name: 2-benzylsulfanyl-4-phenyl-6-(trifluoromethyl)pyrimidine CAS Name: 4-phenyl-2-(phenylmethylthio)-6-(trifluoromethyl)pyrimidine IUPAC Name: 2-benzylsulfanyl-4-phenyl-6-(trifluoromethyl)pyrimidine Traditional Name: 2-(benzylthio)-4-phenyl-6-(trifluoromethyl)pyrimidine Formula: C18H13F3N2S MolecularWeight: 346.36943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C18H13F3N2S/c19-18(20,21)16-11-15(14-9-5-2-6-10-14)22-17(23-16)24-12-13-7-3-1-4-8-13/h1-11H,12H2