2-methoxy-6-[[4-[4-methyl-5-(2-piperidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]phenol

Systemtic Name: 2-methoxy-6-[[4-[4-methyl-5-(2-piperidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]phenol Openeye Name: 2-methoxy-6-[[4-[4-methyl-5-[2-(1-piperidyl)ethylsulfanyl]-1,2,4-triazol-3-yl]-1-piperidyl]methyl]phenol CAS Name: 2-methoxy-6-[[4-[4-methyl-5-[2-(1-piperidinyl)ethylthio]-1,2,4-triazol-3-yl]-1-piperidinyl]methyl]phenol IUPAC Name: 2-methoxy-6-[[4-[4-methyl-5-(2-piperidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]phenol Traditional Name: 2-methoxy-6-[[4-[4-methyl-5-(2-piperidinoethylthio)-1,2,4-triazol-3-yl]piperidino]methyl]phenol Formula: C23H35N5O2S MolecularWeight: 445.6213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCN2CCCCC2)C3CCN(CC3)CC4=C(C(=CC=C4)OC)O

Isomeric SMILES

CN1C(=NN=C1SCCN2CCCCC2)C3CCN(CC3)CC4=C(C(=CC=C4)OC)O

InChI

InChI=1S/C23H35N5O2S/c1-26-22(24-25-23(26)31-16-15-27-11-4-3-5-12-27)18-9-13-28(14-10-18)17-19-7-6-8-20(30-2)21(19)29/h6-8,18,29H,3-5,9-17H2,1-2H3