2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[[3-(trifluoromethyl)phenyl]methylthio]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[[3-(trifluoromethyl)benzyl]thio]-1,4,5,6-tetrahydropyrimidine Formula: C12H13F3N2S MolecularWeight: 274.30523

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NC1)SCC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1CNC(=NC1)SCC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C12H13F3N2S/c13-12(14,15)10-4-1-3-9(7-10)8-18-11-16-5-2-6-17-11/h1,3-4,7H,2,5-6,8H2,(H,16,17)