N-cyclopropyl-3-[6-(6-methoxypyridin-3-yl)purin-9-yl]-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[6-(6-methoxypyridin-3-yl)purin-9-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[6-(6-methoxy-3-pyridyl)purin-9-yl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[6-(6-methoxy-3-pyridinyl)-9-purinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[6-(6-methoxypyridin-3-yl)purin-9-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[6-(6-methoxy-3-pyridyl)purin-9-yl]-4-methyl-benzamide Formula: C22H20N6O2 MolecularWeight: 400.4332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(N=CN=C43)C5=CN=C(C=C5)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(N=CN=C43)C5=CN=C(C=C5)OC

InChI

InChI=1S/C22H20N6O2/c1-13-3-4-14(22(29)27-16-6-7-16)9-17(13)28-12-26-20-19(24-11-25-21(20)28)15-5-8-18(30-2)23-10-15/h3-5,8-12,16H,6-7H2,1-2H3,(H,27,29)