Vitas-M small molecule compound
(5E)-3-(butan-2-yl)-5-(3-chlorobenzylidene)-1,3-thiazolidine-2,4-dione
Catalog ID
STL416422
SMILES CCC(N1C(=O)S/C(=C/c2cccc(c2)Cl)/C1=O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C14H14ClNO2S MW 295.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14ClNO2S/c1-3-9(2)16-13(17)12(19-14(16)18)8-10-5-4-6-11(15)7-10/h4-9H,3H2,1-2H3/b12-8+InChIKey
LEAKGKQTXFILOT-XYOKQWHBSA-NSynonyms
(5E)3(butan2yl)5(3chlorobenzylidene)13thiazolidine24dione
(5E)3BUTAN2YL5((3CHLOROPHENYL)METHYLIDENE)13THIAZOLIDINE24DIONE
CCC(C)N1C(=O)C(=CC2=CC(=CC=C2)Cl)SC1=O
CCC(N1C(=O)SC(=Cc2cccc(c2)Cl)C1=O)C
InChI=1SC14H14ClNO2Sc139(2)1613(17)12(1914(16)18)81054611(15)710h49H3H212H3b128+
MFCD03698798
ZINC000004648612
ZINC000004648613
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