2-[[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)piperazino]methyl]-1H-quinazolin-4-one Formula: C23H21ClN6O2 MolecularWeight: 448.90484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)C4=C(C(=O)N(N=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)C4=C(C(=O)N(N=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C23H21ClN6O2/c24-21-19(14-25-30(23(21)32)16-6-2-1-3-7-16)29-12-10-28(11-13-29)15-20-26-18-9-5-4-8-17(18)22(31)27-20/h1-9,14H,10-13,15H2,(H,26,27,31)