5-azanyl-4-methylsulfonyl-2-[2-methylsulfonyl-3-(trifluoromethyl)phenyl]pyridazin-3-one

Systemtic Name: 5-azanyl-4-methylsulfonyl-2-[2-methylsulfonyl-3-(trifluoromethyl)phenyl]pyridazin-3-one Openeye Name: 5-amino-4-methylsulfonyl-2-[2-methylsulfonyl-3-(trifluoromethyl)phenyl]pyridazin-3-one CAS Name: 5-amino-4-methylsulfonyl-2-[2-methylsulfonyl-3-(trifluoromethyl)phenyl]-3-pyridazinone IUPAC Name: 5-amino-4-methylsulfonyl-2-[2-methylsulfonyl-3-(trifluoromethyl)phenyl]pyridazin-3-one Traditional Name: 5-amino-4-mesyl-2-[2-mesyl-3-(trifluoromethyl)phenyl]pyridazin-3-one Formula: C13H12F3N3O5S2 MolecularWeight: 411.37669

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC=C1N2C(=O)C(=C(C=N2)N)S(=O)(=O)C)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC=C1N2C(=O)C(=C(C=N2)N)S(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C13H12F3N3O5S2/c1-25(21,22)10-7(13(14,15)16)4-3-5-9(10)19-12(20)11(26(2,23)24)8(17)6-18-19/h3-6H,17H2,1-2H3