4-[4-(diphenylmethyl)piperazin-1-yl]-2-methylsulfanyl-6-(trifluoromethyl)pyrimidine

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-2-methylsulfanyl-6-(trifluoromethyl)pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-2-methylsulfanyl-6-(trifluoromethyl)pyrimidine CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-2-(methylthio)-6-(trifluoromethyl)pyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-2-methylsulfanyl-6-(trifluoromethyl)pyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-2-(methylthio)-6-(trifluoromethyl)pyrimidine Formula: C23H23F3N4S MolecularWeight: 444.51573

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CSC1=NC(=CC(=N1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H23F3N4S/c1-31-22-27-19(23(24,25)26)16-20(28-22)29-12-14-30(15-13-29)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,16,21H,12-15H2,1H3