N6-(3-chlorophenyl)-9-ethyl-N2-(2-pyridin-2-ylethyl)purine-2,6-diamine

Systemtic Name: N6-(3-chlorophenyl)-9-ethyl-N2-(2-pyridin-2-ylethyl)purine-2,6-diamine Openeye Name: N6-(3-chlorophenyl)-9-ethyl-N2-[2-(2-pyridyl)ethyl]purine-2,6-diamine CAS Name: N6-(3-chlorophenyl)-9-ethyl-N2-[2-(2-pyridinyl)ethyl]purine-2,6-diamine IUPAC Name: 6-N-(3-chlorophenyl)-9-ethyl-2-N-(2-pyridin-2-ylethyl)purine-2,6-diamine Traditional Name: [6-(3-chloroanilino)-9-ethyl-purin-2-yl]-[2-(2-pyridyl)ethyl]amine Formula: C20H20ClN7 MolecularWeight: 393.8727

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCCC4=CC=CC=N4

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCCC4=CC=CC=N4

InChI

InChI=1S/C20H20ClN7/c1-2-28-13-24-17-18(25-16-8-5-6-14(21)12-16)26-20(27-19(17)28)23-11-9-15-7-3-4-10-22-15/h3-8,10,12-13H,2,9,11H2,1H3,(H2,23,25,26,27)