4-[1-methyl-2-piperidin-4-yl-5-[3-(trifluoromethyl)phenyl]imidazol-4-yl]-2-methylsulfanyl-pyrimidine

Systemtic Name: 4-[1-methyl-2-piperidin-4-yl-5-[3-(trifluoromethyl)phenyl]imidazol-4-yl]-2-methylsulfanyl-pyrimidine Openeye Name: 4-[1-methyl-2-(4-piperidyl)-5-[3-(trifluoromethyl)phenyl]imidazol-4-yl]-2-methylsulfanyl-pyrimidine CAS Name: 4-[1-methyl-2-(4-piperidinyl)-5-[3-(trifluoromethyl)phenyl]-4-imidazolyl]-2-(methylthio)pyrimidine IUPAC Name: 4-[1-methyl-2-piperidin-4-yl-5-[3-(trifluoromethyl)phenyl]imidazol-4-yl]-2-methylsulfanylpyrimidine Traditional Name: 4-[1-methyl-2-(4-piperidyl)-5-[3-(trifluoromethyl)phenyl]imidazol-4-yl]-2-(methylthio)pyrimidine Formula: C21H22F3N5S MolecularWeight: 433.49309

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=C1C2=CC(=CC=C2)C(F)(F)F)C3=NC(=NC=C3)SC)C4CCNCC4

Isomeric SMILES

CN1C(=NC(=C1C2=CC(=CC=C2)C(F)(F)F)C3=NC(=NC=C3)SC)C4CCNCC4

InChI

InChI=1S/C21H22F3N5S/c1-29-18(14-4-3-5-15(12-14)21(22,23)24)17(16-8-11-26-20(27-16)30-2)28-19(29)13-6-9-25-10-7-13/h3-5,8,11-13,25H,6-7,9-10H2,1-2H3