2-(phenylmethylsulfanyl)-5-[3-(trifluoromethyl)phenyl]pyrimidine

Systemtic Name: 2-(phenylmethylsulfanyl)-5-[3-(trifluoromethyl)phenyl]pyrimidine Openeye Name: 2-benzylsulfanyl-5-[3-(trifluoromethyl)phenyl]pyrimidine CAS Name: 2-(phenylmethylthio)-5-[3-(trifluoromethyl)phenyl]pyrimidine IUPAC Name: 2-benzylsulfanyl-5-[3-(trifluoromethyl)phenyl]pyrimidine Traditional Name: 2-(benzylthio)-5-[3-(trifluoromethyl)phenyl]pyrimidine Formula: C18H13F3N2S MolecularWeight: 346.36943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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