2-tert-butyl-4-[3-[4-(methoxymethoxy)phenyl]-2-methyl-4-methylsulfonyl-phenyl]carbonyl-1H-pyrazol-3-one

Systemtic Name: 2-tert-butyl-4-[3-[4-(methoxymethoxy)phenyl]-2-methyl-4-methylsulfonyl-phenyl]carbonyl-1H-pyrazol-3-one Openeye Name: 2-tert-butyl-4-[3-[4-(methoxymethoxy)phenyl]-2-methyl-4-methylsulfonyl-benzoyl]-1H-pyrazol-3-one CAS Name: 2-tert-butyl-4-[[3-[4-(methoxymethoxy)phenyl]-2-methyl-4-methylsulfonylphenyl]-oxomethyl]-1H-pyrazol-3-one IUPAC Name: 2-tert-butyl-4-[3-[4-(methoxymethoxy)phenyl]-2-methyl-4-methylsulfonylbenzoyl]-1H-pyrazol-3-one Traditional Name: 2-tert-butyl-4-[4-mesyl-3-[4-(methoxymethoxy)phenyl]-2-methyl-benzoyl]-3-pyrazolin-3-one Formula: C24H28N2O6S MolecularWeight: 472.55392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C2=CC=C(C=C2)OCOC)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1C2=CC=C(C=C2)OCOC)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C(C)(C)C

InChI

InChI=1S/C24H28N2O6S/c1-15-18(22(27)19-13-25-26(23(19)28)24(2,3)4)11-12-20(33(6,29)30)21(15)16-7-9-17(10-8-16)32-14-31-5/h7-13,25H,14H2,1-6H3