2-[[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]methyl]-7-chloranyl-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]methyl]-7-chloranyl-1H-quinazolin-4-one Openeye Name: 2-[[4-(5-bromo-2-pyridyl)piperazin-1-yl]methyl]-7-chloro-1H-quinazolin-4-one CAS Name: 2-[[4-(5-bromo-2-pyridinyl)-1-piperazinyl]methyl]-7-chloro-1H-quinazolin-4-one IUPAC Name: 2-[[4-(5-bromopyridin-2-yl)piperazin-1-yl]methyl]-7-chloro-1H-quinazolin-4-one Traditional Name: 2-[[4-(5-bromo-2-pyridyl)piperazino]methyl]-7-chloro-1H-quinazolin-4-one Formula: C18H17BrClN5O MolecularWeight: 434.71748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C4=NC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C4=NC=C(C=C4)Br

InChI

InChI=1S/C18H17BrClN5O/c19-12-1-4-17(21-10-12)25-7-5-24(6-8-25)11-16-22-15-9-13(20)2-3-14(15)18(26)23-16/h1-4,9-10H,5-8,11H2,(H,22,23,26)