N-ethyl-4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)benzenesulfonamide; 3-oxidanylidenehexanoic acid

Systemtic Name: N-ethyl-4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)benzenesulfonamide; 3-oxidanylidenehexanoic acid Openeye Name: N-ethyl-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonamide; 3-oxohexanoic acid CAS Name: N-ethyl-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonamide; 3-oxohexanoic acid IUPAC Name: N-ethyl-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonamide; 3-oxohexanoic acid Traditional Name: N-ethyl-4-(5-keto-3-methyl-2-pyrazolin-1-yl)benzenesulfonamide; 3-ketohexanoic acid Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)CC(=O)O.CCNS(=O)(=O)C1=CC=C(C=C1)N2C(=O)CC(=N2)C

Isomeric SMILES

CCCC(=O)CC(=O)O.CCNS(=O)(=O)C1=CC=C(C=C1)N2C(=O)CC(=N2)C

InChI

InChI=1S/C12H15N3O3S.C6H10O3/c1-3-13-19(17,18)11-6-4-10(5-7-11)15-12(16)8-9(2)14-15;1-2-3-5(7)4-6(8)9/h4-7,13H,3,8H2,1-2H3;2-4H2,1H3,(H,8,9)