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

Systemtic Name: 5-(4-fluorophenyl)-4-methyl-2-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 5-(4-fluorophenyl)-2-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 5-(4-fluorophenyl)-2-[(4-hydroxy-1-piperidin-1-iumyl)methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 5-(4-fluorophenyl)-2-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 5-(4-fluorophenyl)-2-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C15H20FN4OS+ MolecularWeight: 323.408903

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+]2CCC(CC2)O)C3=CC=C(C=C3)F

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+]2CCC(CC2)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C15H19FN4OS/c1-18-14(11-2-4-12(16)5-3-11)17-20(15(18)22)10-19-8-6-13(21)7-9-19/h2-5,13,21H,6-10H2,1H3/p+1