N2-(4-butylphenyl)-N3-(5-methyl-2-phenyl-pyrazol-3-yl)quinoxaline-2,3-diamine

Systemtic Name: N2-(4-butylphenyl)-N3-(5-methyl-2-phenyl-pyrazol-3-yl)quinoxaline-2,3-diamine Openeye Name: N2-(4-butylphenyl)-N3-(5-methyl-2-phenyl-pyrazol-3-yl)quinoxaline-2,3-diamine CAS Name: N2-(4-butylphenyl)-N3-(5-methyl-2-phenyl-3-pyrazolyl)quinoxaline-2,3-diamine IUPAC Name: 2-N-(4-butylphenyl)-3-N-(5-methyl-2-phenylpyrazol-3-yl)quinoxaline-2,3-diamine Traditional Name: [3-(4-butylanilino)quinoxalin-2-yl]-(5-methyl-2-phenyl-pyrazol-3-yl)amine Formula: C28H28N6 MolecularWeight: 448.56212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NC4=CC(=NN4C5=CC=CC=C5)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NC4=CC(=NN4C5=CC=CC=C5)C

InChI

InChI=1S/C28H28N6/c1-3-4-10-21-15-17-22(18-16-21)29-27-28(31-25-14-9-8-13-24(25)30-27)32-26-19-20(2)33-34(26)23-11-6-5-7-12-23/h5-9,11-19H,3-4,10H2,1-2H3,(H,29,30)(H,31,32)