compound 30 [PMID: 22468970] (Q27076551)

CHEMBL2058262 (English)

3 October 2016

chemical formula

C₁₈H₁₄F₉NO₃S

1 reference

CHEMBL2058262 (English)

3 October 2016

canonical SMILES

CC(CC(F)(F)F)(CC(F)(F)F)CN1C(=O)C(=CC2=CC(=C(C=C2)O)C(F)(F)F)SC1=O

1 reference

CHEMBL2058262 (English)

3 October 2016

isomeric SMILES

CC(CC(F)(F)F)(CC(F)(F)F)CN1C(=O)/C(=C/C2=CC(=C(C=C2)O)C(F)(F)F)/SC1=O

1 reference

CHEMBL2058262 (English)

InChI=1S/C18H14F9NO3S/c1-15(6-16(19,20)21,7-17(22,23)24)8-28-13(30)12(32-14(28)31)5-9-2-3-11(29)10(4-9)18(25,26)27/h2-5,29H,6-8H2,1H3/b12-5-

3 October 2016

Identifiers

InChI

1 reference

CHEMBL2058262 (English)

KSFQOHIAWRETBP-XGICHPGQSA-N

3 October 2016

InChIKey

1 reference

CHEMBL2058262 (English)

3 October 2016

1 reference

(5Z)-5-[4-Hydroxy-3-(trifluoromethyl)benzylidene]-3-[4,4,4-trifluoro-2-methyl-2-(2,2,2-trifluoroethyl)butyl]-1,3-thiazolidine-2,4-dione (English)

3 October 2016

2 references

CHEMBL2058262 (English)

matched by identifier from

3 October 2016

InChIKey

KSFQOHIAWRETBP-XGICHPGQSA-N

1 reference

Guide to Pharmacology Ligand ID

CHEMBL2058262 (English)

3 October 2016

1 reference

8885

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

8885

compound 30 [PMID: 22468970] (English)