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

Systemtic Name: N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-2-phenyl-triazole-4-carboxamide CAS Name: N-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-2-phenyl-4-triazolecarboxamide IUPAC Name: N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-2-phenyltriazole-4-carboxamide Traditional Name: N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-N-methyl-2-phenyl-triazole-4-carboxamide Formula: C17H23N6O2+ MolecularWeight: 343.40352

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=NN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=NN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H22N6O2/c1-20-8-10-22(11-9-20)16(24)13-21(2)17(25)15-12-18-23(19-15)14-6-4-3-5-7-14/h3-7,12H,8-11,13H2,1-2H3/p+1