N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-(2-methoxyphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(2-methoxyphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C29H32N5O2+ MolecularWeight: 482.59668

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CN(N=C3C4=CC=CC=C4OC)C5=CC=CC=C5

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CN(N=C3C4=CC=CC=C4OC)C5=CC=CC=C5

InChI

InChI=1S/C29H31N5O2/c1-3-32-17-19-33(20-18-32)23-15-13-22(14-16-23)30-29(35)26-21-34(24-9-5-4-6-10-24)31-28(26)25-11-7-8-12-27(25)36-2/h4-16,21H,3,17-20H2,1-2H3,(H,30,35)/p+1