2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-5-ethylsulfonyl-1,3-benzoxazole

Systemtic Name: 2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-5-ethylsulfonyl-1,3-benzoxazole Openeye Name: 2-(4,4-difluorobut-3-enylsulfanyl)-5-ethylsulfonyl-1,3-benzoxazole CAS Name: 2-(4,4-difluorobut-3-enylthio)-5-ethylsulfonyl-1,3-benzoxazole IUPAC Name: 2-(4,4-difluorobut-3-enylsulfanyl)-5-ethylsulfonyl-1,3-benzoxazole Traditional Name: 2-(4,4-difluorobut-3-enylthio)-5-esyl-1,3-benzoxazole Formula: C13H13F2NO3S2 MolecularWeight: 333.374026

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCCC=C(F)F

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCCC=C(F)F

InChI

InChI=1S/C13H13F2NO3S2/c1-2-21(17,18)9-5-6-11-10(8-9)16-13(19-11)20-7-3-4-12(14)15/h4-6,8H,2-3,7H2,1H3