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

Systemtic Name: 4-[2-chloranyl-4-methylsulfonyl-3-[(3-phenyl-1,2-oxazol-5-yl)methoxy]phenyl]carbonyl-2,5-dimethyl-1H-pyrazol-3-one Openeye Name: 4-[2-chloro-4-methylsulfonyl-3-[(3-phenylisoxazol-5-yl)methoxy]benzoyl]-2,5-dimethyl-1H-pyrazol-3-one CAS Name: 4-[[2-chloro-4-methylsulfonyl-3-[(3-phenyl-5-isoxazolyl)methoxy]phenyl]-oxomethyl]-2,5-dimethyl-1H-pyrazol-3-one IUPAC Name: 4-[2-chloro-4-methylsulfonyl-3-[(3-phenyl-1,2-oxazol-5-yl)methoxy]benzoyl]-2,5-dimethyl-1H-pyrazol-3-one Traditional Name: 4-[2-chloro-4-mesyl-3-[(3-phenylisoxazol-5-yl)methoxy]benzoyl]-2,5-dimethyl-3-pyrazolin-3-one Formula: C23H20ClN3O6S MolecularWeight: 501.9394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)OCC3=CC(=NO3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1)C)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)OCC3=CC(=NO3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H20ClN3O6S/c1-13-19(23(29)27(2)25-13)21(28)16-9-10-18(34(3,30)31)22(20(16)24)32-12-15-11-17(26-33-15)14-7-5-4-6-8-14/h4-11,25H,12H2,1-3H3