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

Systemtic Name: 2-(2-methylpropylsulfanyl)-5-[3-(trifluoromethyl)phenyl]pyrimidine Openeye Name: 2-isobutylsulfanyl-5-[3-(trifluoromethyl)phenyl]pyrimidine CAS Name: 2-(2-methylpropylthio)-5-[3-(trifluoromethyl)phenyl]pyrimidine IUPAC Name: 2-(2-methylpropylsulfanyl)-5-[3-(trifluoromethyl)phenyl]pyrimidine Traditional Name: 2-(isobutylthio)-5-[3-(trifluoromethyl)phenyl]pyrimidine Formula: C15H15F3N2S MolecularWeight: 312.35321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC=C(C=N1)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CC(C)CSC1=NC=C(C=N1)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C15H15F3N2S/c1-10(2)9-21-14-19-7-12(8-20-14)11-4-3-5-13(6-11)15(16,17)18/h3-8,10H,9H2,1-2H3