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

Systemtic Name: 1-[3-(4-methylphenyl)-1-(phenylmethyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[1-benzyl-3-(p-tolyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[3-(4-methylphenyl)-1-(phenylmethyl)-4-pyrazolyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[1-benzyl-3-(4-methylphenyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-[1-benzyl-3-(p-tolyl)pyrazol-4-yl]methylene-(4-methylpiperazin-4-ium-1-yl)amine Formula: C23H28N5+ MolecularWeight: 374.50192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=NN3CC[NH+](CC3)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=N\N3CC[NH+](CC3)C)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5/c1-19-8-10-21(11-9-19)23-22(16-24-27-14-12-26(2)13-15-27)18-28(25-23)17-20-6-4-3-5-7-20/h3-11,16,18H,12-15,17H2,1-2H3/p+1/b24-16-