1,1-bis(fluoranyl)-4-(phenylmethylsulfanyl)butan-2-one

Systemtic Name: 1,1-bis(fluoranyl)-4-(phenylmethylsulfanyl)butan-2-one Openeye Name: 4-benzylsulfanyl-1,1-difluoro-butan-2-one CAS Name: 1,1-difluoro-4-(phenylmethylthio)-2-butanone IUPAC Name: 4-benzylsulfanyl-1,1-difluorobutan-2-one Traditional Name: 4-(benzylthio)-1,1-difluoro-butan-2-one Formula: C11H12F2OS MolecularWeight: 230.274186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC(=O)C(F)F

Isomeric SMILES

C1=CC=C(C=C1)CSCCC(=O)C(F)F

InChI

InChI=1S/C11H12F2OS/c12-11(13)10(14)6-7-15-8-9-4-2-1-3-5-9/h1-5,11H,6-8H2