N-[2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-1,3-benzoxazol-4-yl]methanesulfonamide

Systemtic Name: N-[2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-1,3-benzoxazol-4-yl]methanesulfonamide Openeye Name: N-[2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzoxazol-4-yl]methanesulfonamide CAS Name: N-[2-(4,4-difluorobut-3-enylthio)-1,3-benzoxazol-4-yl]methanesulfonamide IUPAC Name: N-[2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzoxazol-4-yl]methanesulfonamide Traditional Name: N-[2-(4,4-difluorobut-3-enylthio)-1,3-benzoxazol-4-yl]methanesulfonamide Formula: C12H12F2N2O3S2 MolecularWeight: 334.362086

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C2C(=CC=C1)OC(=N2)SCCC=C(F)F

Isomeric SMILES

CS(=O)(=O)NC1=C2C(=CC=C1)OC(=N2)SCCC=C(F)F

InChI

InChI=1S/C12H12F2N2O3S2/c1-21(17,18)16-8-4-2-5-9-11(8)15-12(19-9)20-7-3-6-10(13)14/h2,4-6,16H,3,7H2,1H3