1-(furan-3-ylmethyl)-4-[4-methyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidine

Systemtic Name: 1-(furan-3-ylmethyl)-4-[4-methyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidine Openeye Name: 1-(3-furylmethyl)-4-[4-methyl-5-(tetrahydrofuran-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidine CAS Name: 1-(3-furanylmethyl)-4-[4-methyl-5-(2-oxolanylmethylthio)-1,2,4-triazol-3-yl]piperidine IUPAC Name: 1-(furan-3-ylmethyl)-4-[4-methyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidine Traditional Name: 1-(3-furfuryl)-4-[4-methyl-5-(tetrahydrofurfurylthio)-1,2,4-triazol-3-yl]piperidine Formula: C18H26N4O2S MolecularWeight: 362.48964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2CCCO2)C3CCN(CC3)CC4=COC=C4

Isomeric SMILES

CN1C(=NN=C1SCC2CCCO2)C3CCN(CC3)CC4=COC=C4

InChI

InChI=1S/C18H26N4O2S/c1-21-17(19-20-18(21)25-13-16-3-2-9-24-16)15-4-7-22(8-5-15)11-14-6-10-23-12-14/h6,10,12,15-16H,2-5,7-9,11,13H2,1H3