5-[(4-methoxyphenoxy)methyl]-4-methyl-2-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-[(4-methoxyphenoxy)methyl]-4-methyl-2-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-[(4-methoxyphenoxy)methyl]-4-methyl-2-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 5-[(4-methoxyphenoxy)methyl]-4-methyl-2-(1-piperidin-1-iumylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-[(4-methoxyphenoxy)methyl]-4-methyl-2-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 5-[(4-methoxyphenoxy)methyl]-4-methyl-2-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazole-3-thione Formula: C17H25N4O2S+ MolecularWeight: 349.471

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+]2CCCCC2)COC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+]2CCCCC2)COC3=CC=C(C=C3)OC

InChI

InChI=1S/C17H24N4O2S/c1-19-16(12-23-15-8-6-14(22-2)7-9-15)18-21(17(19)24)13-20-10-4-3-5-11-20/h6-9H,3-5,10-13H2,1-2H3/p+1