7-phenethyl-2-pyridin-4-yl-3H-purin-6-one

Systemtic Name: 7-phenethyl-2-pyridin-4-yl-3H-purin-6-one Openeye Name: 7-phenethyl-2-(4-pyridyl)-3H-purin-6-one CAS Name: 7-phenethyl-2-pyridin-4-yl-3H-purin-6-one IUPAC Name: 7-phenethyl-2-pyridin-4-yl-3H-purin-6-one Traditional Name: 7-phenethyl-2-(4-pyridyl)-3H-purin-6-one Formula: C18H15N5O MolecularWeight: 317.3446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C=NC3=C2C(=O)N=C(N3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C=NC3=C2C(=O)N=C(N3)C4=CC=NC=C4

InChI

InChI=1S/C18H15N5O/c24-18-15-17(21-16(22-18)14-6-9-19-10-7-14)20-12-23(15)11-8-13-4-2-1-3-5-13/h1-7,9-10,12H,8,11H2,(H,21,22,24)