2-(azepan-1-yl)-6-phenyl-1H-pyrimidin-4-one

Systemtic Name: 2-(azepan-1-yl)-6-phenyl-1H-pyrimidin-4-one Openeye Name: 2-(azepan-1-yl)-6-phenyl-1H-pyrimidin-4-one CAS Name: 2-(1-azepanyl)-6-phenyl-1H-pyrimidin-4-one IUPAC Name: 2-(azepan-1-yl)-6-phenyl-1H-pyrimidin-4-one Traditional Name: 2-(azepan-1-yl)-6-phenyl-1H-pyrimidin-4-one Formula: C16H19N3O MolecularWeight: 269.34156

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C2=NC(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3O/c20-15-12-14(13-8-4-3-5-9-13)17-16(18-15)19-10-6-1-2-7-11-19/h3-5,8-9,12H,1-2,6-7,10-11H2,(H,17,18,20)