4-[2-morpholin-4-yl-9-(phenylmethyl)purin-6-yl]-1H-pyridin-2-one

Systemtic Name: 4-[2-morpholin-4-yl-9-(phenylmethyl)purin-6-yl]-1H-pyridin-2-one Openeye Name: 4-(9-benzyl-2-morpholino-purin-6-yl)-1H-pyridin-2-one CAS Name: 4-[2-(4-morpholinyl)-9-(phenylmethyl)-6-purinyl]-1H-pyridin-2-one IUPAC Name: 4-(9-benzyl-2-morpholin-4-ylpurin-6-yl)-1H-pyridin-2-one Traditional Name: 4-(9-benzyl-2-morpholino-purin-6-yl)-2-pyridone Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=C3C(=N2)N(C=N3)CC4=CC=CC=C4)C5=CC(=O)NC=C5

Isomeric SMILES

C1COCCN1C2=NC(=C3C(=N2)N(C=N3)CC4=CC=CC=C4)C5=CC(=O)NC=C5

InChI

InChI=1S/C21H20N6O2/c28-17-12-16(6-7-22-17)18-19-20(25-21(24-18)26-8-10-29-11-9-26)27(14-23-19)13-15-4-2-1-3-5-15/h1-7,12,14H,8-11,13H2,(H,22,28)