3-[[4-[5-(cyclohexylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]pyridine

Systemtic Name: 3-[[4-[5-(cyclohexylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]pyridine Openeye Name: 3-[[4-[4-allyl-5-(cyclohexylmethylsulfanyl)-1,2,4-triazol-3-yl]-1-piperidyl]methyl]pyridine CAS Name: 3-[[4-[5-(cyclohexylmethylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]-1-piperidinyl]methyl]pyridine IUPAC Name: 3-[[4-[5-(cyclohexylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]pyridine Traditional Name: 3-[[4-[4-allyl-5-(cyclohexylmethylthio)-1,2,4-triazol-3-yl]piperidino]methyl]pyridine Formula: C23H33N5S MolecularWeight: 411.60662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2CCCCC2)C3CCN(CC3)CC4=CN=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2CCCCC2)C3CCN(CC3)CC4=CN=CC=C4

InChI

InChI=1S/C23H33N5S/c1-2-13-28-22(25-26-23(28)29-18-19-7-4-3-5-8-19)21-10-14-27(15-11-21)17-20-9-6-12-24-16-20/h2,6,9,12,16,19,21H,1,3-5,7-8,10-11,13-15,17-18H2