N-[4-(4-methylpiperazin-4-ium-1-yl)carbonyl-2-phenyl-pyrazol-3-yl]benzamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)carbonyl-2-phenyl-pyrazol-3-yl]benzamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-carbonyl)-2-phenyl-pyrazol-3-yl]benzamide CAS Name: N-[4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-2-phenyl-3-pyrazolyl]benzamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-carbonyl)-2-phenylpyrazol-3-yl]benzamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-carbonyl)-2-phenyl-pyrazol-3-yl]benzamide Formula: C22H24N5O2+ MolecularWeight: 390.45826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5O2/c1-25-12-14-26(15-13-25)22(29)19-16-23-27(18-10-6-3-7-11-18)20(19)24-21(28)17-8-4-2-5-9-17/h2-11,16H,12-15H2,1H3,(H,24,28)/p+1