4-[3-(3-fluoranyl-4-methoxy-phenyl)-5-(methylsulfanylmethyl)-1,2-oxazol-4-yl]benzenesulfonamide

Systemtic Name: 4-[3-(3-fluoranyl-4-methoxy-phenyl)-5-(methylsulfanylmethyl)-1,2-oxazol-4-yl]benzenesulfonamide Openeye Name: 4-[3-(3-fluoro-4-methoxy-phenyl)-5-(methylsulfanylmethyl)isoxazol-4-yl]benzenesulfonamide CAS Name: 4-[3-(3-fluoro-4-methoxyphenyl)-5-[(methylthio)methyl]-4-isoxazolyl]benzenesulfonamide IUPAC Name: 4-[3-(3-fluoro-4-methoxyphenyl)-5-(methylsulfanylmethyl)-1,2-oxazol-4-yl]benzenesulfonamide Traditional Name: 4-[3-(3-fluoro-4-methoxy-phenyl)-5-[(methylthio)methyl]isoxazol-4-yl]benzenesulfonamide Formula: C18H17FN2O4S2 MolecularWeight: 408.466983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=C2C3=CC=C(C=C3)S(=O)(=O)N)CSC)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=C2C3=CC=C(C=C3)S(=O)(=O)N)CSC)F

InChI

InChI=1S/C18H17FN2O4S2/c1-24-15-8-5-12(9-14(15)19)18-17(16(10-26-2)25-21-18)11-3-6-13(7-4-11)27(20,22)23/h3-9H,10H2,1-2H3,(H2,20,22,23)