N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-5-(2-thienyl)pyrazole-3-carboxamide Formula: C25H25ClN5OS+ MolecularWeight: 479.0169

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C25H24ClN5OS/c1-29-11-13-30(14-12-29)22-10-9-18(26)16-20(22)27-25(32)23-17-21(24-8-5-15-33-24)28-31(23)19-6-3-2-4-7-19/h2-10,15-17H,11-14H2,1H3,(H,27,32)/p+1