N-(4-hexylphenyl)-2-phenyl-6-pyrazol-1-yl-pyrimidin-4-amine

Systemtic Name: N-(4-hexylphenyl)-2-phenyl-6-pyrazol-1-yl-pyrimidin-4-amine Openeye Name: N-(4-hexylphenyl)-2-phenyl-6-pyrazol-1-yl-pyrimidin-4-amine CAS Name: N-(4-hexylphenyl)-2-phenyl-6-(1-pyrazolyl)-4-pyrimidinamine IUPAC Name: N-(4-hexylphenyl)-2-phenyl-6-pyrazol-1-ylpyrimidin-4-amine Traditional Name: (4-hexylphenyl)-(2-phenyl-6-pyrazol-1-yl-pyrimidin-4-yl)amine Formula: C25H27N5 MolecularWeight: 397.51538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)NC2=NC(=NC(=C2)N3C=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)NC2=NC(=NC(=C2)N3C=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N5/c1-2-3-4-6-10-20-13-15-22(16-14-20)27-23-19-24(30-18-9-17-26-30)29-25(28-23)21-11-7-5-8-12-21/h5,7-9,11-19H,2-4,6,10H2,1H3,(H,27,28,29)