5-cyclopropyl-2-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione

Systemtic Name: 5-cyclopropyl-2-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Openeye Name: 5-cyclopropyl-2-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 5-cyclopropyl-2-[[4-[2-(4-methoxyphenyl)ethyl]-1-piperidin-1-iumyl]methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 5-cyclopropyl-2-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 5-cyclopropyl-2-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C21H31N4OS+ MolecularWeight: 387.56204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+]2CCC(CC2)CCC3=CC=C(C=C3)OC)C4CC4

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+]2CCC(CC2)CCC3=CC=C(C=C3)OC)C4CC4

InChI

InChI=1S/C21H30N4OS/c1-23-20(18-7-8-18)22-25(21(23)27)15-24-13-11-17(12-14-24)4-3-16-5-9-19(26-2)10-6-16/h5-6,9-10,17-18H,3-4,7-8,11-15H2,1-2H3/p+1