2-[[4-(7-chloranylquinazolin-4-yl)piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(7-chloranylquinazolin-4-yl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-(7-chloroquinazolin-4-yl)piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-(7-chloro-4-quinazolinyl)-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(7-chloroquinazolin-4-yl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-(7-chloroquinazolin-4-yl)piperazino]methyl]-1H-quinazolin-4-one Formula: C21H19ClN6O MolecularWeight: 406.86816

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)C4=NC=NC5=C4C=CC(=C5)Cl

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)C4=NC=NC5=C4C=CC(=C5)Cl

InChI

InChI=1S/C21H19ClN6O/c22-14-5-6-15-18(11-14)23-13-24-20(15)28-9-7-27(8-10-28)12-19-25-17-4-2-1-3-16(17)21(29)26-19/h1-6,11,13H,7-10,12H2,(H,25,26,29)