9-cyclopropyl-N-(2,4-dimethoxyphenyl)-8-pyridin-4-yl-purin-2-amine

Systemtic Name: 9-cyclopropyl-N-(2,4-dimethoxyphenyl)-8-pyridin-4-yl-purin-2-amine Openeye Name: 9-cyclopropyl-N-(2,4-dimethoxyphenyl)-8-(4-pyridyl)purin-2-amine CAS Name: 9-cyclopropyl-N-(2,4-dimethoxyphenyl)-8-pyridin-4-yl-2-purinamine IUPAC Name: 9-cyclopropyl-N-(2,4-dimethoxyphenyl)-8-pyridin-4-ylpurin-2-amine Traditional Name: [9-cyclopropyl-8-(4-pyridyl)purin-2-yl]-(2,4-dimethoxyphenyl)amine Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=CC=NC=C4)C5CC5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=CC=NC=C4)C5CC5)OC

InChI

InChI=1S/C21H20N6O2/c1-28-15-5-6-16(18(11-15)29-2)25-21-23-12-17-20(26-21)27(14-3-4-14)19(24-17)13-7-9-22-10-8-13/h5-12,14H,3-4H2,1-2H3,(H,23,25,26)