4,6-bis[[4-(trifluoromethyl)phenyl]sulfanyl]hexan-2-one

Systemtic Name: 4,6-bis[[4-(trifluoromethyl)phenyl]sulfanyl]hexan-2-one Openeye Name: 4,6-bis[[4-(trifluoromethyl)phenyl]sulfanyl]hexan-2-one CAS Name: 4,6-bis[[4-(trifluoromethyl)phenyl]thio]-2-hexanone IUPAC Name: 4,6-bis[[4-(trifluoromethyl)phenyl]sulfanyl]hexan-2-one Traditional Name: 4,6-bis[[4-(trifluoromethyl)phenyl]thio]hexan-2-one Formula: C20H18F6OS2 MolecularWeight: 452.476739

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CCSC1=CC=C(C=C1)C(F)(F)F)SC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(=O)CC(CCSC1=CC=C(C=C1)C(F)(F)F)SC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C20H18F6OS2/c1-13(27)12-18(29-17-8-4-15(5-9-17)20(24,25)26)10-11-28-16-6-2-14(3-7-16)19(21,22)23/h2-9,18H,10-12H2,1H3