3-[[3-[(8-oxidanyl-1,6-naphthyridin-7-yl)carbonyl]-5-(phenylmethyl)phenyl]methyl]pyrimidin-4-one

Systemtic Name: 3-[[3-[(8-oxidanyl-1,6-naphthyridin-7-yl)carbonyl]-5-(phenylmethyl)phenyl]methyl]pyrimidin-4-one Openeye Name: 3-[[3-benzyl-5-(8-hydroxy-1,6-naphthyridine-7-carbonyl)phenyl]methyl]pyrimidin-4-one CAS Name: 3-[[3-[(8-hydroxy-1,6-naphthyridin-7-yl)-oxomethyl]-5-(phenylmethyl)phenyl]methyl]-4-pyrimidinone IUPAC Name: 3-[[3-benzyl-5-(8-hydroxy-1,6-naphthyridine-7-carbonyl)phenyl]methyl]pyrimidin-4-one Traditional Name: 3-[3-benzyl-5-(8-hydroxy-1,6-naphthyridine-7-carbonyl)benzyl]pyrimidin-4-one Formula: C27H20N4O3 MolecularWeight: 448.4727

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=CC(=C2)C(=O)C3=NC=C4C=CC=NC4=C3O)CN5C=NC=CC5=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=CC(=C2)C(=O)C3=NC=C4C=CC=NC4=C3O)CN5C=NC=CC5=O

InChI

InChI=1S/C27H20N4O3/c32-23-8-10-28-17-31(23)16-20-12-19(11-18-5-2-1-3-6-18)13-22(14-20)26(33)25-27(34)24-21(15-30-25)7-4-9-29-24/h1-10,12-15,17,34H,11,16H2