1-[3,4-bis(fluoranyl)phenyl]-2-(2-methylpropylsulfanyl)propan-1-one

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]-2-(2-methylpropylsulfanyl)propan-1-one Openeye Name: 1-(3,4-difluorophenyl)-2-isobutylsulfanyl-propan-1-one CAS Name: 1-(3,4-difluorophenyl)-2-(2-methylpropylthio)-1-propanone IUPAC Name: 1-(3,4-difluorophenyl)-2-(2-methylpropylsulfanyl)propan-1-one Traditional Name: 1-(3,4-difluorophenyl)-2-(isobutylthio)propan-1-one Formula: C13H16F2OS MolecularWeight: 258.327346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16F2OS/c1-8(2)7-17-9(3)13(16)10-4-5-11(14)12(15)6-10/h4-6,8-9H,7H2,1-3H3