2-[(4-methylphenyl)methyl]-5-(phenylazanylmethyl)pyrazole-3,4-diamine

Systemtic Name: 2-[(4-methylphenyl)methyl]-5-(phenylazanylmethyl)pyrazole-3,4-diamine Openeye Name: 5-(anilinomethyl)-2-(p-tolylmethyl)pyrazole-3,4-diamine CAS Name: 5-(anilinomethyl)-2-[(4-methylphenyl)methyl]pyrazole-3,4-diamine IUPAC Name: 5-(anilinomethyl)-2-[(4-methylphenyl)methyl]pyrazole-3,4-diamine Traditional Name: [4,5-diamino-1-(4-methylbenzyl)pyrazol-3-yl]methyl-phenyl-amine Formula: C18H21N5 MolecularWeight: 307.39284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)CNC3=CC=CC=C3)N)N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)CNC3=CC=CC=C3)N)N

InChI

InChI=1S/C18H21N5/c1-13-7-9-14(10-8-13)12-23-18(20)17(19)16(22-23)11-21-15-5-3-2-4-6-15/h2-10,21H,11-12,19-20H2,1H3