4-[2,5-bis(fluoranyl)phenyl]sulfanyl-1-(4-fluorophenyl)butan-1-one

Systemtic Name: 4-[2,5-bis(fluoranyl)phenyl]sulfanyl-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-(2,5-difluorophenyl)sulfanyl-1-(4-fluorophenyl)butan-1-one CAS Name: 4-[(2,5-difluorophenyl)thio]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-(2,5-difluorophenyl)sulfanyl-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[(2,5-difluorophenyl)thio]-1-(4-fluorophenyl)butan-1-one Formula: C16H13F3OS MolecularWeight: 310.33403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCSC2=C(C=CC(=C2)F)F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCSC2=C(C=CC(=C2)F)F)F

InChI

InChI=1S/C16H13F3OS/c17-12-5-3-11(4-6-12)15(20)2-1-9-21-16-10-13(18)7-8-14(16)19/h3-8,10H,1-2,9H2