4-[2-chloranyl-3-(2-ethoxymorpholin-4-yl)-4-methylsulfonyl-phenyl]carbonyl-2-ethyl-1H-pyrazol-3-one

Systemtic Name: 4-[2-chloranyl-3-(2-ethoxymorpholin-4-yl)-4-methylsulfonyl-phenyl]carbonyl-2-ethyl-1H-pyrazol-3-one Openeye Name: 4-[2-chloro-3-(2-ethoxymorpholin-4-yl)-4-methylsulfonyl-benzoyl]-2-ethyl-1H-pyrazol-3-one CAS Name: 4-[[2-chloro-3-(2-ethoxy-4-morpholinyl)-4-methylsulfonylphenyl]-oxomethyl]-2-ethyl-1H-pyrazol-3-one IUPAC Name: 4-[2-chloro-3-(2-ethoxymorpholin-4-yl)-4-methylsulfonylbenzoyl]-2-ethyl-1H-pyrazol-3-one Traditional Name: 4-[2-chloro-3-(2-ethoxymorpholino)-4-mesyl-benzoyl]-2-ethyl-3-pyrazolin-3-one Formula: C19H24ClN3O6S MolecularWeight: 457.92836

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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)N3CCOC(C3)OCC)Cl

Isomeric SMILES

CCN1C(=O)C(=CN1)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)N3CCOC(C3)OCC)Cl

InChI

InChI=1S/C19H24ClN3O6S/c1-4-23-19(25)13(10-21-23)18(24)12-6-7-14(30(3,26)27)17(16(12)20)22-8-9-29-15(11-22)28-5-2/h6-7,10,15,21H,4-5,8-9,11H2,1-3H3