5-[4-(5-bromanyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one

Systemtic Name: 5-[4-(5-bromanyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one Openeye Name: 5-[4-(5-bromo-2-hydroxy-benzoyl)piperazin-1-yl]-4-chloro-2-phenyl-pyridazin-3-one CAS Name: 5-[4-[(5-bromo-2-hydroxyphenyl)-oxomethyl]-1-piperazinyl]-4-chloro-2-phenyl-3-pyridazinone IUPAC Name: 5-[4-(5-bromo-2-hydroxybenzoyl)piperazin-1-yl]-4-chloro-2-phenylpyridazin-3-one Traditional Name: 5-[4-(5-bromo-2-hydroxy-benzoyl)piperazino]-4-chloro-2-phenyl-pyridazin-3-one Formula: C21H18BrClN4O3 MolecularWeight: 489.74962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=C(C=CC(=C4)Br)O

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=C(C=CC(=C4)Br)O

InChI

InChI=1S/C21H18BrClN4O3/c22-14-6-7-18(28)16(12-14)20(29)26-10-8-25(9-11-26)17-13-24-27(21(30)19(17)23)15-4-2-1-3-5-15/h1-7,12-13,28H,8-11H2