N-(4-methylpiperazin-4-ium-1-yl)-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-(4-methylpiperazin-4-ium-1-yl)-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-(4-methyl-1-piperazin-4-iumyl)-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-(4-methylpiperazin-4-ium-1-yl)-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-(4-methylpiperazin-4-ium-1-yl)-1,3-diphenyl-pyrazole-4-carboxamide Formula: C21H24N5O+ MolecularWeight: 362.44816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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