3-(5-chloranylpyridin-2-yl)-2-[4-(2-oxidanylidene-1,3-diazepan-1-yl)phenyl]quinazolin-4-one

Systemtic Name: 3-(5-chloranylpyridin-2-yl)-2-[4-(2-oxidanylidene-1,3-diazepan-1-yl)phenyl]quinazolin-4-one Openeye Name: 3-(5-chloro-2-pyridyl)-2-[4-(2-oxo-1,3-diazepan-1-yl)phenyl]quinazolin-4-one CAS Name: 3-(5-chloro-2-pyridinyl)-2-[4-(2-oxo-1,3-diazepan-1-yl)phenyl]-4-quinazolinone IUPAC Name: 3-(5-chloropyridin-2-yl)-2-[4-(2-oxo-1,3-diazepan-1-yl)phenyl]quinazolin-4-one Traditional Name: 3-(5-chloro-2-pyridyl)-2-[4-(2-keto-1,3-diazepan-1-yl)phenyl]quinazolin-4-one Formula: C24H20ClN5O2 MolecularWeight: 445.9009

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)NC1)C2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=O)N3C5=NC=C(C=C5)Cl

Isomeric SMILES

C1CCN(C(=O)NC1)C2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=O)N3C5=NC=C(C=C5)Cl

InChI

InChI=1S/C24H20ClN5O2/c25-17-9-12-21(27-15-17)30-22(28-20-6-2-1-5-19(20)23(30)31)16-7-10-18(11-8-16)29-14-4-3-13-26-24(29)32/h1-2,5-12,15H,3-4,13-14H2,(H,26,32)