9-ethyl-N-(3-ethylphenyl)-8-pyridin-4-yl-purin-2-amine

Systemtic Name: 9-ethyl-N-(3-ethylphenyl)-8-pyridin-4-yl-purin-2-amine Openeye Name: 9-ethyl-N-(3-ethylphenyl)-8-(4-pyridyl)purin-2-amine CAS Name: 9-ethyl-N-(3-ethylphenyl)-8-pyridin-4-yl-2-purinamine IUPAC Name: 9-ethyl-N-(3-ethylphenyl)-8-pyridin-4-ylpurin-2-amine Traditional Name: (3-ethylphenyl)-[9-ethyl-8-(4-pyridyl)purin-2-yl]amine Formula: C20H20N6 MolecularWeight: 344.413

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=CC=NC=C4)CC

Isomeric SMILES

CCC1=CC(=CC=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=CC=NC=C4)CC

InChI

InChI=1S/C20H20N6/c1-3-14-6-5-7-16(12-14)23-20-22-13-17-19(25-20)26(4-2)18(24-17)15-8-10-21-11-9-15/h5-13H,3-4H2,1-2H3,(H,22,23,25)