2-[[4-(furan-2-ylmethyl)-5-propyl-1,2,4-triazol-3-yl]sulfanyl]-1-(2-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-5-propyl-1,2,4-triazol-3-yl]sulfanyl]-1-(2-methylpiperidin-1-yl)ethanone Openeye Name: 2-[[4-(2-furylmethyl)-5-propyl-1,2,4-triazol-3-yl]sulfanyl]-1-(2-methyl-1-piperidyl)ethanone CAS Name: 2-[[4-(2-furanylmethyl)-5-propyl-1,2,4-triazol-3-yl]thio]-1-(2-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[[4-(furan-2-ylmethyl)-5-propyl-1,2,4-triazol-3-yl]sulfanyl]-1-(2-methylpiperidin-1-yl)ethanone Traditional Name: 2-[[4-(2-furfuryl)-5-propyl-1,2,4-triazol-3-yl]thio]-1-(2-methylpiperidino)ethanone Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1CC2=CC=CO2)SCC(=O)N3CCCCC3C

Isomeric SMILES

CCCC1=NN=C(N1CC2=CC=CO2)SCC(=O)N3CCCCC3C

InChI

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