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

Systemtic Name: 9-cyclopropyl-8-[2-(methylamino)pyrimidin-4-yl]-N-(3-methylphenyl)purin-2-amine Openeye Name: 9-cyclopropyl-8-[2-(methylamino)pyrimidin-4-yl]-N-(m-tolyl)purin-2-amine CAS Name: 9-cyclopropyl-8-[2-(methylamino)-4-pyrimidinyl]-N-(3-methylphenyl)-2-purinamine IUPAC Name: 9-cyclopropyl-8-[2-(methylamino)pyrimidin-4-yl]-N-(3-methylphenyl)purin-2-amine Traditional Name: [9-cyclopropyl-8-[2-(methylamino)pyrimidin-4-yl]purin-2-yl]-(m-tolyl)amine Formula: C20H20N8 MolecularWeight: 372.4264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=NC(=NC=C4)NC)C5CC5

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=NC(=NC=C4)NC)C5CC5

InChI

InChI=1S/C20H20N8/c1-12-4-3-5-13(10-12)24-20-23-11-16-18(27-20)28(14-6-7-14)17(25-16)15-8-9-22-19(21-2)26-15/h3-5,8-11,14H,6-7H2,1-2H3,(H,21,22,26)(H,23,24,27)