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

Systemtic Name: 4-[2-chloranyl-3-(4,5-dihydro-1,2-oxazol-3-yl)-4-methylsulfanyl-phenyl]carbonyl-2-cyclopropyl-1H-pyrazol-3-one Openeye Name: 4-[2-chloro-3-(4,5-dihydroisoxazol-3-yl)-4-methylsulfanyl-benzoyl]-2-cyclopropyl-1H-pyrazol-3-one CAS Name: 4-[[2-chloro-3-(4,5-dihydroisoxazol-3-yl)-4-(methylthio)phenyl]-oxomethyl]-2-cyclopropyl-1H-pyrazol-3-one IUPAC Name: 4-[2-chloro-3-(4,5-dihydro-1,2-oxazol-3-yl)-4-methylsulfanylbenzoyl]-2-cyclopropyl-1H-pyrazol-3-one Traditional Name: 4-[2-chloro-3-(2-isoxazolin-3-yl)-4-(methylthio)benzoyl]-2-cyclopropyl-3-pyrazolin-3-one Formula: C17H16ClN3O3S MolecularWeight: 377.84524

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=C(C=C1)C(=O)C2=CNN(C2=O)C3CC3)Cl)C4=NOCC4

Isomeric SMILES

CSC1=C(C(=C(C=C1)C(=O)C2=CNN(C2=O)C3CC3)Cl)C4=NOCC4

InChI

InChI=1S/C17H16ClN3O3S/c1-25-13-5-4-10(15(18)14(13)12-6-7-24-20-12)16(22)11-8-19-21(17(11)23)9-2-3-9/h4-5,8-9,19H,2-3,6-7H2,1H3