1-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-1-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methanimine CAS Name: 1-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(4-methylpiperazin-4-ium-1-yl)-[[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methylene]amine Formula: C22H26N5+ MolecularWeight: 360.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=NN3CC[NH+](CC3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=N\N3CC[NH+](CC3)C)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5/c1-18-8-10-19(11-9-18)22-20(16-23-26-14-12-25(2)13-15-26)17-27(24-22)21-6-4-3-5-7-21/h3-11,16-17H,12-15H2,1-2H3/p+1/b23-16-