3-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-8-methyl-quinazolin-4-one

Systemtic Name: 3-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-8-methyl-quinazolin-4-one Openeye Name: 3-[2-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-2-oxo-ethyl]-8-methyl-quinazolin-4-one CAS Name: 3-[2-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-2-oxoethyl]-8-methyl-4-quinazolinone IUPAC Name: 3-[2-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-2-oxoethyl]-8-methylquinazolin-4-one Traditional Name: 3-[2-[4-(5-bromo-2-pyridyl)piperazino]-2-keto-ethyl]-8-methyl-quinazolin-4-one Formula: C20H20BrN5O2 MolecularWeight: 442.3091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

InChI

InChI=1S/C20H20BrN5O2/c1-14-3-2-4-16-19(14)23-13-26(20(16)28)12-18(27)25-9-7-24(8-10-25)17-6-5-15(21)11-22-17/h2-6,11,13H,7-10,12H2,1H3