5-cyclopropyl-2-methyl-4-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]carbonyl-1H-pyrazol-3-one

Systemtic Name: 5-cyclopropyl-2-methyl-4-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]carbonyl-1H-pyrazol-3-one Openeye Name: 5-cyclopropyl-2-methyl-4-[2-methylsulfonyl-4-(trifluoromethyl)benzoyl]-1H-pyrazol-3-one CAS Name: 5-cyclopropyl-2-methyl-4-[[2-methylsulfonyl-4-(trifluoromethyl)phenyl]-oxomethyl]-1H-pyrazol-3-one IUPAC Name: 5-cyclopropyl-2-methyl-4-[2-methylsulfonyl-4-(trifluoromethyl)benzoyl]-1H-pyrazol-3-one Traditional Name: 5-cyclopropyl-4-[2-mesyl-4-(trifluoromethyl)benzoyl]-2-methyl-3-pyrazolin-3-one Formula: C16H15F3N2O4S MolecularWeight: 388.36151

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N1)C2CC2)C(=O)C3=C(C=C(C=C3)C(F)(F)F)S(=O)(=O)C

Isomeric SMILES

CN1C(=O)C(=C(N1)C2CC2)C(=O)C3=C(C=C(C=C3)C(F)(F)F)S(=O)(=O)C

InChI

InChI=1S/C16H15F3N2O4S/c1-21-15(23)12(13(20-21)8-3-4-8)14(22)10-6-5-9(16(17,18)19)7-11(10)26(2,24)25/h5-8,20H,3-4H2,1-2H3