5-[4-[3,5-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one

Systemtic Name: 5-[4-[3,5-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[4-(3,5-difluorobenzoyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[4-[(3,5-difluorophenyl)-oxomethyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[4-(3,5-difluorobenzoyl)piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[4-(3,5-difluorobenzoyl)piperazino]-2-phenyl-pyridazin-3-one Formula: C21H17ClF2N4O2 MolecularWeight: 430.835086

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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=CC(=CC(=C4)F)F

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClF2N4O2/c22-19-18(13-25-28(21(19)30)17-4-2-1-3-5-17)26-6-8-27(9-7-26)20(29)14-10-15(23)12-16(24)11-14/h1-5,10-13H,6-9H2