5-[2-chloranyl-3-(3-methyl-4,5-dihydro-1,2-oxazol-5-yl)-4-methylsulfonyl-phenyl]carbonyl-2-cyclopropyl-1H-pyrazol-3-one

Systemtic Name: 5-[2-chloranyl-3-(3-methyl-4,5-dihydro-1,2-oxazol-5-yl)-4-methylsulfonyl-phenyl]carbonyl-2-cyclopropyl-1H-pyrazol-3-one Openeye Name: 5-[2-chloro-3-(3-methyl-4,5-dihydroisoxazol-5-yl)-4-methylsulfonyl-benzoyl]-2-cyclopropyl-1H-pyrazol-3-one CAS Name: 5-[[2-chloro-3-(3-methyl-4,5-dihydroisoxazol-5-yl)-4-methylsulfonylphenyl]-oxomethyl]-2-cyclopropyl-1H-pyrazol-3-one IUPAC Name: 5-[2-chloro-3-(3-methyl-4,5-dihydro-1,2-oxazol-5-yl)-4-methylsulfonylbenzoyl]-2-cyclopropyl-1H-pyrazol-3-one Traditional Name: 5-[2-chloro-4-mesyl-3-(3-methyl-2-isoxazolin-5-yl)benzoyl]-2-cyclopropyl-3-pyrazolin-3-one Formula: C18H18ClN3O5S MolecularWeight: 423.87062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(C1)C2=C(C=CC(=C2Cl)C(=O)C3=CC(=O)N(N3)C4CC4)S(=O)(=O)C

Isomeric SMILES

CC1=NOC(C1)C2=C(C=CC(=C2Cl)C(=O)C3=CC(=O)N(N3)C4CC4)S(=O)(=O)C

InChI

InChI=1S/C18H18ClN3O5S/c1-9-7-13(27-21-9)16-14(28(2,25)26)6-5-11(17(16)19)18(24)12-8-15(23)22(20-12)10-3-4-10/h5-6,8,10,13,20H,3-4,7H2,1-2H3