N'-(4-cyano-1H-pyrazol-5-yl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]ethanediamide

Systemtic Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]ethanediamide Openeye Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]oxamide CAS Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-[3-(4-methyl-1-piperazin-4-iumyl)propyl]oxamide IUPAC Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]oxamide Traditional Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]oxamide Formula: C14H22N7O2+ MolecularWeight: 320.37018

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCNC(=O)C(=O)NC2=C(C=NN2)C#N

Isomeric SMILES

C[NH+]1CCN(CC1)CCCNC(=O)C(=O)NC2=C(C=NN2)C#N

InChI

InChI=1S/C14H21N7O2/c1-20-5-7-21(8-6-20)4-2-3-16-13(22)14(23)18-12-11(9-15)10-17-19-12/h10H,2-8H2,1H3,(H,16,22)(H2,17,18,19,23)/p+1