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

Systemtic Name: 5-(2-chlorophenyl)-4-methyl-2-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 5-(2-chlorophenyl)-2-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 5-(2-chlorophenyl)-2-[[(3R)-3-hydroxy-1-piperidin-1-iumyl]methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 5-(2-chlorophenyl)-2-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 5-(2-chlorophenyl)-2-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C15H20ClN4OS+ MolecularWeight: 339.8635

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+]2CCCC(C2)O)C3=CC=CC=C3Cl

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+]2CCC[C@H](C2)O)C3=CC=CC=C3Cl

InChI

InChI=1S/C15H19ClN4OS/c1-18-14(12-6-2-3-7-13(12)16)17-20(15(18)22)10-19-8-4-5-11(21)9-19/h2-3,6-7,11,21H,4-5,8-10H2,1H3/p+1/t11-/m1/s1