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

Systemtic Name: 5-[[(4-aminophenyl)amino]methyl]-2-[(4-methylphenyl)methyl]pyrazole-3,4-diamine Openeye Name: 5-[(4-aminoanilino)methyl]-2-(p-tolylmethyl)pyrazole-3,4-diamine CAS Name: 5-[(4-aminoanilino)methyl]-2-[(4-methylphenyl)methyl]pyrazole-3,4-diamine IUPAC Name: 5-[(4-aminoanilino)methyl]-2-[(4-methylphenyl)methyl]pyrazole-3,4-diamine Traditional Name: (4-aminophenyl)-[[4,5-diamino-1-(4-methylbenzyl)pyrazol-3-yl]methyl]amine Formula: C18H22N6 MolecularWeight: 322.40748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N6/c1-12-2-4-13(5-3-12)11-24-18(21)17(20)16(23-24)10-22-15-8-6-14(19)7-9-15/h2-9,22H,10-11,19-21H2,1H3