2-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one

Systemtic Name: 2-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one Openeye Name: 2-[2-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-2-oxo-ethyl]phthalazin-1-one CAS Name: 2-[2-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-2-oxoethyl]-1-phthalazinone IUPAC Name: 2-[2-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-2-oxoethyl]phthalazin-1-one Traditional Name: 2-[2-[4-(5-bromo-2-pyridyl)piperazino]-2-keto-ethyl]phthalazin-1-one Formula: C19H18BrN5O2 MolecularWeight: 428.28252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C19H18BrN5O2/c20-15-5-6-17(21-12-15)23-7-9-24(10-8-23)18(26)13-25-19(27)16-4-2-1-3-14(16)11-22-25/h1-6,11-12H,7-10,13H2