4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonyl-phenyl]carbonyl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonyl-phenyl]carbonyl-1,2-dihydropyrazol-3-one Openeye Name: 4-[3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-methylsulfonyl-benzoyl]-1,2-dihydropyrazol-3-one CAS Name: 4-[[3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-methylsulfonylphenyl]-oxomethyl]-1,2-dihydropyrazol-3-one IUPAC Name: 4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-1,2-dihydropyrazol-3-one Traditional Name: 4-[3-(2-isoxazolin-3-yl)-4-mesyl-2-methyl-benzoyl]-3-pyrazolin-3-one Formula: C15H15N3O5S MolecularWeight: 349.3617

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNNC3=O

Isomeric SMILES

CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNNC3=O

InChI

InChI=1S/C15H15N3O5S/c1-8-9(14(19)10-7-16-17-15(10)20)3-4-12(24(2,21)22)13(8)11-5-6-23-18-11/h3-4,7H,5-6H2,1-2H3,(H2,16,17,20)