4-(2-chloranyl-4-methylsulfonyl-3-phenyl-phenyl)carbonyl-2-ethyl-1H-pyrazol-3-one

Systemtic Name: 4-(2-chloranyl-4-methylsulfonyl-3-phenyl-phenyl)carbonyl-2-ethyl-1H-pyrazol-3-one Openeye Name: 4-(2-chloro-4-methylsulfonyl-3-phenyl-benzoyl)-2-ethyl-1H-pyrazol-3-one CAS Name: 4-[(2-chloro-4-methylsulfonyl-3-phenylphenyl)-oxomethyl]-2-ethyl-1H-pyrazol-3-one IUPAC Name: 4-(2-chloro-4-methylsulfonyl-3-phenylbenzoyl)-2-ethyl-1H-pyrazol-3-one Traditional Name: 4-(2-chloro-4-mesyl-3-phenyl-benzoyl)-2-ethyl-3-pyrazolin-3-one Formula: C19H17ClN2O4S MolecularWeight: 404.86728

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CN1)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3)Cl

Isomeric SMILES

CCN1C(=O)C(=CN1)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3)Cl

InChI

InChI=1S/C19H17ClN2O4S/c1-3-22-19(24)14(11-21-22)18(23)13-9-10-15(27(2,25)26)16(17(13)20)12-7-5-4-6-8-12/h4-11,21H,3H2,1-2H3