1-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[5-chloro-3-methyl-1-(p-tolylmethyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-[5-chloro-3-methyl-1-(4-methylbenzyl)pyrazol-4-yl]methylene-(4-methylpiperazin-4-ium-1-yl)amine Formula: C18H25ClN5+ MolecularWeight: 346.8776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=NN3CC[NH+](CC3)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)/C=N\N3CC[NH+](CC3)C)Cl

InChI

InChI=1S/C18H24ClN5/c1-14-4-6-16(7-5-14)13-24-18(19)17(15(2)21-24)12-20-23-10-8-22(3)9-11-23/h4-7,12H,8-11,13H2,1-3H3/p+1/b20-12-