[1-[[1-(2-methylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]methyl]-1,2,3-triazol-4-yl]methylazanium

Systemtic Name: [1-[[1-(2-methylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]methyl]-1,2,3-triazol-4-yl]methylazanium Openeye Name: [1-[[1-(2-methylsulfanylpyridine-3-carbonyl)-4-piperidyl]methyl]triazol-4-yl]methylammonium CAS Name: [1-[[1-[[2-(methylthio)-3-pyridinyl]-oxomethyl]-4-piperidinyl]methyl]-4-triazolyl]methylammonium IUPAC Name: [1-[[1-(2-methylsulfanylpyridine-3-carbonyl)piperidin-4-yl]methyl]triazol-4-yl]methylazanium Traditional Name: [1-[[1-[2-(methylthio)nicotinoyl]-4-piperidyl]methyl]triazol-4-yl]methylammonium Formula: C16H23N6OS+ MolecularWeight: 347.45842

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CCC(CC2)CN3C=C(N=N3)C[NH3+]

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CCC(CC2)CN3C=C(N=N3)C[NH3+]

InChI

InChI=1S/C16H22N6OS/c1-24-15-14(3-2-6-18-15)16(23)21-7-4-12(5-8-21)10-22-11-13(9-17)19-20-22/h2-3,6,11-12H,4-5,7-10,17H2,1H3/p+1