9-(2,4-dimethylphenyl)-8-methyl-N-(4-pyridin-4-ylphenyl)purin-6-amine

Systemtic Name: 9-(2,4-dimethylphenyl)-8-methyl-N-(4-pyridin-4-ylphenyl)purin-6-amine Openeye Name: 9-(2,4-dimethylphenyl)-8-methyl-N-[4-(4-pyridyl)phenyl]purin-6-amine CAS Name: 9-(2,4-dimethylphenyl)-8-methyl-N-(4-pyridin-4-ylphenyl)-6-purinamine IUPAC Name: 9-(2,4-dimethylphenyl)-8-methyl-N-(4-pyridin-4-ylphenyl)purin-6-amine Traditional Name: [9-(2,4-dimethylphenyl)-8-methyl-purin-6-yl]-[4-(4-pyridyl)phenyl]amine Formula: C25H22N6 MolecularWeight: 406.48238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NC3=C2N=CN=C3NC4=CC=C(C=C4)C5=CC=NC=C5)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NC3=C2N=CN=C3NC4=CC=C(C=C4)C5=CC=NC=C5)C)C

InChI

InChI=1S/C25H22N6/c1-16-4-9-22(17(2)14-16)31-18(3)29-23-24(27-15-28-25(23)31)30-21-7-5-19(6-8-21)20-10-12-26-13-11-20/h4-15H,1-3H3,(H,27,28,30)