9-cyclopropyl-N-(3-methoxyphenyl)-8-pyrimidin-4-yl-purin-2-amine

Systemtic Name: 9-cyclopropyl-N-(3-methoxyphenyl)-8-pyrimidin-4-yl-purin-2-amine Openeye Name: 9-cyclopropyl-N-(3-methoxyphenyl)-8-pyrimidin-4-yl-purin-2-amine CAS Name: 9-cyclopropyl-N-(3-methoxyphenyl)-8-(4-pyrimidinyl)-2-purinamine IUPAC Name: 9-cyclopropyl-N-(3-methoxyphenyl)-8-pyrimidin-4-ylpurin-2-amine Traditional Name: [9-cyclopropyl-8-(4-pyrimidyl)purin-2-yl]-(3-methoxyphenyl)amine Formula: C19H17N7O MolecularWeight: 359.38458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N7O/c1-27-14-4-2-3-12(9-14)23-19-21-10-16-18(25-19)26(13-5-6-13)17(24-16)15-7-8-20-11-22-15/h2-4,7-11,13H,5-6H2,1H3,(H,21,23,25)