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

Systemtic Name: 1-(4-chlorophenyl)-5-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]pyrazole-4-carboxamide Openeye Name: 1-(4-chlorophenyl)-5-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]pyrazole-4-carboxamide CAS Name: 1-(4-chlorophenyl)-5-methyl-N-[[4-(4-methyl-1-piperazin-4-iumyl)phenyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-5-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]pyrazole-4-carboxamide Traditional Name: 1-(4-chlorophenyl)-5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)benzyl]pyrazole-4-carboxamide Formula: C23H27ClN5O+ MolecularWeight: 424.94638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C23H26ClN5O/c1-17-22(16-26-29(17)21-9-5-19(24)6-10-21)23(30)25-15-18-3-7-20(8-4-18)28-13-11-27(2)12-14-28/h3-10,16H,11-15H2,1-2H3,(H,25,30)/p+1