3-fluoranyl-4-methoxy-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide

Systemtic Name: 3-fluoranyl-4-methoxy-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-3-fluoro-4-methoxy-benzenesulfonamide CAS Name: 3-fluoro-4-methoxy-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]benzenesulfonamide IUPAC Name: 3-fluoro-4-methoxy-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-3-fluoro-4-methoxy-benzenesulfonamide Formula: C12H12FN3O3S3 MolecularWeight: 361.435383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=NN=C(S2)SCC=C)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=NN=C(S2)SCC=C)F

InChI

InChI=1S/C12H12FN3O3S3/c1-3-6-20-12-15-14-11(21-12)16-22(17,18)8-4-5-10(19-2)9(13)7-8/h3-5,7H,1,6H2,2H3,(H,14,16)