2-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[(3R)-3-hydroxy-1-piperidin-1-iumyl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione Formula: C12H17N4OS2+ MolecularWeight: 297.41958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CN2C(=S)N=C(N2)C3=CC=CS3)O

Isomeric SMILES

C1C[C@H](C[NH+](C1)CN2C(=S)N=C(N2)C3=CC=CS3)O

InChI

InChI=1S/C12H16N4OS2/c17-9-3-1-5-15(7-9)8-16-12(18)13-11(14-16)10-4-2-6-19-10/h2,4,6,9,17H,1,3,5,7-8H2,(H,13,14,18)/p+1/t9-/m1/s1