6-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-5-one

Systemtic Name: 6-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-5-one Openeye Name: 6-[2-(azepan-1-yl)-2-oxo-ethyl]-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-5-one CAS Name: 6-[2-(1-azepanyl)-2-oxoethyl]-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-5-one IUPAC Name: 6-[2-(azepan-1-yl)-2-oxoethyl]-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-5-one Traditional Name: 6-[2-(azepan-1-yl)-2-keto-ethyl]-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-5-one Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CC2CN3C(=NC2=O)C(=CN3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)CC2CN3C(=NC2=O)C(=CN3)C4=CC=CC=C4

InChI

InChI=1S/C20H24N4O2/c25-18(23-10-6-1-2-7-11-23)12-16-14-24-19(22-20(16)26)17(13-21-24)15-8-4-3-5-9-15/h3-5,8-9,13,16,21H,1-2,6-7,10-12,14H2