9-ethyl-N-(3-ethylphenyl)-8-[2-(methylamino)pyrimidin-4-yl]purin-2-amine

Systemtic Name: 9-ethyl-N-(3-ethylphenyl)-8-[2-(methylamino)pyrimidin-4-yl]purin-2-amine Openeye Name: 9-ethyl-N-(3-ethylphenyl)-8-[2-(methylamino)pyrimidin-4-yl]purin-2-amine CAS Name: 9-ethyl-N-(3-ethylphenyl)-8-[2-(methylamino)-4-pyrimidinyl]-2-purinamine IUPAC Name: 9-ethyl-N-(3-ethylphenyl)-8-[2-(methylamino)pyrimidin-4-yl]purin-2-amine Traditional Name: [4-[9-ethyl-2-(3-ethylanilino)purin-8-yl]pyrimidin-2-yl]-methyl-amine Formula: C20H22N8 MolecularWeight: 374.44228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N8/c1-4-13-7-6-8-14(11-13)24-20-23-12-16-18(27-20)28(5-2)17(25-16)15-9-10-22-19(21-3)26-15/h6-12H,4-5H2,1-3H3,(H,21,22,26)(H,23,24,27)