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

Systemtic Name: 4-cyclohexyl-2-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-cyclohexyl-2-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-5-(2-thienylmethyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclohexyl-2-[(4-hydroxy-1-piperidin-1-iumyl)methyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-cyclohexyl-2-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 4-cyclohexyl-2-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-5-(2-thenyl)-1,2,4-triazole-3-thione Formula: C19H29N4OS2+ MolecularWeight: 393.58976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN(C2=S)C[NH+]3CCC(CC3)O)CC4=CC=CS4

Isomeric SMILES

C1CCC(CC1)N2C(=NN(C2=S)C[NH+]3CCC(CC3)O)CC4=CC=CS4

InChI

InChI=1S/C19H28N4OS2/c24-16-8-10-21(11-9-16)14-22-19(25)23(15-5-2-1-3-6-15)18(20-22)13-17-7-4-12-26-17/h4,7,12,15-16,24H,1-3,5-6,8-11,13-14H2/p+1