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

Systemtic Name: 2-[3-(3-fluoranyl-4-methoxy-phenyl)-1,2-oxazol-4-yl]-5-(phenylmethyl)benzenesulfonamide Openeye Name: 5-benzyl-2-[3-(3-fluoro-4-methoxy-phenyl)isoxazol-4-yl]benzenesulfonamide CAS Name: 2-[3-(3-fluoro-4-methoxyphenyl)-4-isoxazolyl]-5-(phenylmethyl)benzenesulfonamide IUPAC Name: 5-benzyl-2-[3-(3-fluoro-4-methoxyphenyl)-1,2-oxazol-4-yl]benzenesulfonamide Traditional Name: 5-benzyl-2-[3-(3-fluoro-4-methoxy-phenyl)isoxazol-4-yl]benzenesulfonamide Formula: C23H19FN2O4S MolecularWeight: 438.471363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC=C2C3=C(C=C(C=C3)CC4=CC=CC=C4)S(=O)(=O)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC=C2C3=C(C=C(C=C3)CC4=CC=CC=C4)S(=O)(=O)N)F

InChI

InChI=1S/C23H19FN2O4S/c1-29-21-10-8-17(13-20(21)24)23-19(14-30-26-23)18-9-7-16(12-22(18)31(25,27)28)11-15-5-3-2-4-6-15/h2-10,12-14H,11H2,1H3,(H2,25,27,28)