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M  END
> <ID>
CHEBI:131923

> <NAME>
salubrinal

> <DEFINITION>
A member of the class of quinolines that is a mixed aminal resulting from the formal condensation oftrichloroacetaldehyde with the amide nitrogen of trans-cinnamamide and the primary amino group of 1-quinolin-8-ylthiourea. It is a selective inhibitor of cellular complexes that dephosphorylate eukaryotic translation initiation factor 2 subunit α (eIF2α).

> <STAR>
3

> <SYNONYM>
(E)-3-phenyl-N-[2,2,2-trichloro-1-(quinolin-8-ylcarbamothioylamino)ethyl]prop-2-enamide

> <IUPAC_NAME>
(2E)-3-phenyl-N-{2,2,2-trichloro-1-[(quinolin-8-ylcarbamothioyl)amino]ethyl}acrylamide

> <FORMULA>
C21H17Cl3N4OS

> <MASS>
479.812

> <MONOISOTOPIC_MASS>
478.01887

> <CHARGE>
0

> <SMILES>
C=1C=2C(C(=CC1)NC(NC(NC(/C=C/C=3C=CC=CC3)=O)C(Cl)(Cl)Cl)=S)=NC=CC2

> <INCHI>
InChI=1S/C21H17Cl3N4OS/c22-21(23,24)19(27-17(29)12-11-14-6-2-1-3-7-14)28-20(30)26-16-10-4-8-15-9-5-13-25-18(15)16/h1-13,19H,(H,27,29)(H2,26,28,30)/b12-11+

> <INCHIKEY>
LCOIAYJMPKXARU-VAWYXSNFSA-N

> <CAS_REGISTRY_NUMBER>
405060-95-9

> <REAXYS_REGISTRY_NUMBER>
13925629

> <CHEMIDPLUS>
405060-95-9

> <WIKIPEDIA_ACCESSION>
Salubrinal

> <PUBMED_CITATION>
15705855; 22610062; 23178987; 23473976; 23603983; 23816340; 23824972; 24418467; 24728926; 25030410; 25157407; 25230871; 25435425; 25582550; 25619567; 25816071; 25882497; 25977571; 26021511; 26193263; 26328492; 26505387; 26743901; 26889171; 27123756; 27131989

$$$$