1-(4-methoxyphenyl)-5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)-5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(4-methoxyphenyl)-5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]triazole-4-carboxamide CAS Name: 1-(4-methoxyphenyl)-5-methyl-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-4-triazolecarboxamide IUPAC Name: 1-(4-methoxyphenyl)-5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]triazole-4-carboxamide Traditional Name: 1-(4-methoxyphenyl)-5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]triazole-4-carboxamide Formula: C22H27N6O2+ MolecularWeight: 407.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(N=NN1C2=CC=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C22H26N6O2/c1-16-21(24-25-28(16)19-8-10-20(30-3)11-9-19)22(29)23-17-4-6-18(7-5-17)27-14-12-26(2)13-15-27/h4-11H,12-15H2,1-3H3,(H,23,29)/p+1