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

Systemtic Name: 4-[3-(3-fluoranyl-4-methoxy-phenyl)-5-methylsulfanyl-1,2-oxazol-4-yl]benzenesulfonamide Openeye Name: 4-[3-(3-fluoro-4-methoxy-phenyl)-5-methylsulfanyl-isoxazol-4-yl]benzenesulfonamide CAS Name: 4-[3-(3-fluoro-4-methoxyphenyl)-5-(methylthio)-4-isoxazolyl]benzenesulfonamide IUPAC Name: 4-[3-(3-fluoro-4-methoxyphenyl)-5-methylsulfanyl-1,2-oxazol-4-yl]benzenesulfonamide Traditional Name: 4-[3-(3-fluoro-4-methoxy-phenyl)-5-(methylthio)isoxazol-4-yl]benzenesulfonamide Formula: C17H15FN2O4S2 MolecularWeight: 394.440403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15FN2O4S2/c1-23-14-8-5-11(9-13(14)18)16-15(17(25-2)24-20-16)10-3-6-12(7-4-10)26(19,21)22/h3-9H,1-2H3,(H2,19,21,22)