2-ethyl-4-[3-(1-methoxyethyl)-2-methyl-4-methylsulfonyl-phenyl]carbonyl-1H-pyrazol-3-one

Systemtic Name: 2-ethyl-4-[3-(1-methoxyethyl)-2-methyl-4-methylsulfonyl-phenyl]carbonyl-1H-pyrazol-3-one Openeye Name: 2-ethyl-4-[3-(1-methoxyethyl)-2-methyl-4-methylsulfonyl-benzoyl]-1H-pyrazol-3-one CAS Name: 2-ethyl-4-[[3-(1-methoxyethyl)-2-methyl-4-methylsulfonylphenyl]-oxomethyl]-1H-pyrazol-3-one IUPAC Name: 2-ethyl-4-[3-(1-methoxyethyl)-2-methyl-4-methylsulfonylbenzoyl]-1H-pyrazol-3-one Traditional Name: 2-ethyl-4-[4-mesyl-3-(1-methoxyethyl)-2-methyl-benzoyl]-3-pyrazolin-3-one Formula: C17H22N2O5S MolecularWeight: 366.43198

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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)C(C)OC)C

Isomeric SMILES

CCN1C(=O)C(=CN1)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)C(C)OC)C

InChI

InChI=1S/C17H22N2O5S/c1-6-19-17(21)13(9-18-19)16(20)12-7-8-14(25(5,22)23)15(10(12)2)11(3)24-4/h7-9,11,18H,6H2,1-5H3