5-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-phenyl-pyrazole-1-carboxamide

Systemtic Name: 5-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-phenyl-pyrazole-1-carboxamide Openeye Name: 5-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-phenyl-pyrazole-1-carboxamide CAS Name: 5-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-N-phenyl-1-pyrazolecarboxamide IUPAC Name: 5-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-phenylpyrazole-1-carboxamide Traditional Name: 5-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-phenyl-pyrazole-1-carboxamide Formula: C21H24N5O+ MolecularWeight: 362.44816

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)C3=CC=NN3C(=O)NC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)C3=CC=NN3C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H23N5O/c1-24-13-15-25(16-14-24)19-9-7-17(8-10-19)20-11-12-22-26(20)21(27)23-18-5-3-2-4-6-18/h2-12H,13-16H2,1H3,(H,23,27)/p+1