N-(4-methylpiperazin-4-ium-1-yl)-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-(4-methylpiperazin-4-ium-1-yl)-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-(4-methyl-1-piperazin-4-iumyl)-1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-methylpiperazin-4-ium-1-yl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: N-(4-methylpiperazin-4-ium-1-yl)-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C20H23N6O+ MolecularWeight: 363.43622

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H22N6O/c1-24-10-12-25(13-11-24)23-20(27)18-15-26(17-7-3-2-4-8-17)22-19(18)16-6-5-9-21-14-16/h2-9,14-15H,10-13H2,1H3,(H,23,27)/p+1