2-methyl-6-[[3-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]pyridine

Systemtic Name: 2-methyl-6-[[3-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]pyridine Openeye Name: 2-[[3-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)-1-piperidyl]methyl]-6-methyl-pyridine CAS Name: 2-methyl-6-[[3-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]-1-piperidinyl]methyl]pyridine IUPAC Name: 2-[[3-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]methyl]-6-methylpyridine Traditional Name: 2-[[3-[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]piperidino]methyl]-6-methyl-pyridine Formula: C22H27N5S MolecularWeight: 393.54828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCC(C2)C3=NN=C(N3C)SCC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCC(C2)C3=NN=C(N3C)SCC4=CC=CC=C4

InChI

InChI=1S/C22H27N5S/c1-17-8-6-12-20(23-17)15-27-13-7-11-19(14-27)21-24-25-22(26(21)2)28-16-18-9-4-3-5-10-18/h3-6,8-10,12,19H,7,11,13-16H2,1-2H3