2-[[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]methyl]-6-phenyl-pyridazin-3-one

Systemtic Name: 2-[[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]methyl]-6-phenyl-pyridazin-3-one Openeye Name: 2-[[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenyl-pyridazin-3-one CAS Name: 2-[[4-(2,6-difluorophenyl)sulfonyl-1-piperazinyl]methyl]-6-phenyl-3-pyridazinone IUPAC Name: 2-[[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylpyridazin-3-one Traditional Name: 2-[[4-(2,6-difluorophenyl)sulfonylpiperazino]methyl]-6-phenyl-pyridazin-3-one Formula: C21H20F2N4O3S MolecularWeight: 446.470306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=O)C=CC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=C(C=CC=C4F)F

Isomeric SMILES

C1CN(CCN1CN2C(=O)C=CC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=C(C=CC=C4F)F

InChI

InChI=1S/C21H20F2N4O3S/c22-17-7-4-8-18(23)21(17)31(29,30)26-13-11-25(12-14-26)15-27-20(28)10-9-19(24-27)16-5-2-1-3-6-16/h1-10H,11-15H2