3-[(2-fluoranyl-3-methyl-phenyl)methylsulfonyl]-1H-pyridazin-6-one

Systemtic Name: 3-[(2-fluoranyl-3-methyl-phenyl)methylsulfonyl]-1H-pyridazin-6-one Openeye Name: 3-[(2-fluoro-3-methyl-phenyl)methylsulfonyl]-1H-pyridazin-6-one CAS Name: 3-[(2-fluoro-3-methylphenyl)methylsulfonyl]-1H-pyridazin-6-one IUPAC Name: 3-[(2-fluoro-3-methylphenyl)methylsulfonyl]-1H-pyridazin-6-one Traditional Name: 3-(2-fluoro-3-methyl-benzyl)sulfonyl-1H-pyridazin-6-one Formula: C12H11FN2O3S MolecularWeight: 282.290743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CS(=O)(=O)C2=NNC(=O)C=C2)F

Isomeric SMILES

CC1=C(C(=CC=C1)CS(=O)(=O)C2=NNC(=O)C=C2)F

InChI

InChI=1S/C12H11FN2O3S/c1-8-3-2-4-9(12(8)13)7-19(17,18)11-6-5-10(16)14-15-11/h2-6H,7H2,1H3,(H,14,16)