Vitas-M small molecule compound
3-{(5E)-5-[4-(2-ethoxy-2-oxoethoxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzoic acid
Catalog ID
STK119635
SMILES CCOC(=O)COc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)c1cccc(c1)C(=O)O
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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 C21H17NO6S2 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO6S2/c1-2-27-18(23)12-28-16-8-6-13(7-9-16)10-17-19(24)22(21(29)30-17)15-5-3-4-14(11-15)20(25)26/h3-11H,2,12H2,1H3,(H,25,26)/b17-10+InChIKey
LQPOMBBCSJCJOU-LICLKQGHSA-NSynonyms
3((5E)5((4(2ETHOXY2OXOETHOXY)PHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOICACID
3((5E)5(4(2ETHOXY2OXOETHOXY)BENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BENZOICACID
CCOC(=O)COC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC=CC(=C3)C(=O)O
CCOC(=O)COc1ccc(cc1)C=C1SC(=S)N(C1=O)c1cccc(c1)C(=O)O
InChI=1SC21H17NO6S2c122718(23)1228168613(7916)101719(24)22(21(29)3017)1553414(1115)20(25)26h311H212H21H3(H2526)b1710+
MFCD03994097
ZINC000002829226
ZINC2829226
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