3-[[3-[bis(fluoranyl)methyl]phenyl]methylsulfonyl]-1H-pyridazin-6-one

Systemtic Name: 3-[[3-[bis(fluoranyl)methyl]phenyl]methylsulfonyl]-1H-pyridazin-6-one Openeye Name: 3-[[3-(difluoromethyl)phenyl]methylsulfonyl]-1H-pyridazin-6-one CAS Name: 3-[[3-(difluoromethyl)phenyl]methylsulfonyl]-1H-pyridazin-6-one IUPAC Name: 3-[[3-(difluoromethyl)phenyl]methylsulfonyl]-1H-pyridazin-6-one Traditional Name: 3-[3-(difluoromethyl)benzyl]sulfonyl-1H-pyridazin-6-one Formula: C12H10F2N2O3S MolecularWeight: 300.281206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)F)CS(=O)(=O)C2=NNC(=O)C=C2

Isomeric SMILES

C1=CC(=CC(=C1)C(F)F)CS(=O)(=O)C2=NNC(=O)C=C2

InChI

InChI=1S/C12H10F2N2O3S/c13-12(14)9-3-1-2-8(6-9)7-20(18,19)11-5-4-10(17)15-16-11/h1-6,12H,7H2,(H,15,17)