2-[[4-[5-(2-methoxyethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]piperidin-1-ium-1-yl]methyl]pyridine

Systemtic Name: 2-[[4-[5-(2-methoxyethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]piperidin-1-ium-1-yl]methyl]pyridine Openeye Name: 2-[[4-[5-(2-methoxyethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]piperidin-1-ium-1-yl]methyl]pyridine CAS Name: 2-[[4-[5-(2-methoxyethylthio)-4-methyl-1,2,4-triazol-3-yl]-1-piperidin-1-iumyl]methyl]pyridine IUPAC Name: 2-[[4-[5-(2-methoxyethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]piperidin-1-ium-1-yl]methyl]pyridine Traditional Name: 2-[[4-[5-(2-methoxyethylthio)-4-methyl-1,2,4-triazol-3-yl]piperidin-1-ium-1-yl]methyl]pyridine Formula: C17H26N5OS+ MolecularWeight: 348.48624

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC)C2CC[NH+](CC2)CC3=CC=CC=N3

Isomeric SMILES

CN1C(=NN=C1SCCOC)C2CC[NH+](CC2)CC3=CC=CC=N3

InChI

InChI=1S/C17H25N5OS/c1-21-16(19-20-17(21)24-12-11-23-2)14-6-9-22(10-7-14)13-15-5-3-4-8-18-15/h3-5,8,14H,6-7,9-13H2,1-2H3/p+1