1-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methylene-(4-methylpiperazin-4-ium-1-yl)amine Formula: C20H29N6+ MolecularWeight: 353.48446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NN2CC[NH+](CC2)C)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=N\N2CC[NH+](CC2)C)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C20H28N6/c1-17-19(16-21-25-14-12-23(2)13-15-25)20(24-10-6-7-11-24)26(22-17)18-8-4-3-5-9-18/h3-5,8-9,16H,6-7,10-15H2,1-2H3/p+1/b21-16-