3-[2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonylpyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 3-[2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonylpyrido[1,2-a]pyrimidin-4-one Openeye Name: 3-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 3-[[2-(1-methyl-2-pyrrolyl)-1-azepanyl]-oxomethyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 3-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 3-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2C(=O)C3=CN=C4C=CC=CN4C3=O

Isomeric SMILES

CN1C=CC=C1C2CCCCCN2C(=O)C3=CN=C4C=CC=CN4C3=O

InChI

InChI=1S/C20H22N4O2/c1-22-11-7-9-16(22)17-8-3-2-5-12-23(17)19(25)15-14-21-18-10-4-6-13-24(18)20(15)26/h4,6-7,9-11,13-14,17H,2-3,5,8,12H2,1H3