Vitas-M small molecule compound

methyl 3-[(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate

Catalog ID
STL332472
SMILES CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)CCC(=O)OC

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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 C16H17NO5S2 MW 367.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO5S2/c1-3-22-12-8-10(4-5-11(12)18)9-13-15(20)17(16(23)24-13)7-6-14(19)21-2/h4-5,8-9,18H,3,6-7H2,1-2H3/b13-9-
InChIKey
ZPJGFMLIXUSUMT-LCYFTJDESA-N
Synonyms
303117-37-5
(Z)methyl3(5(3ethoxy4hydroxybenzylidene)4oxo2thioxothiazolidin3yl)propanoate
303117375
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)OC)O
CCOc1cc(ccc1O)C=C1SC(=S)N(C1=O)CCC(=O)OC
InChI=1SC16H17NO5S2c132212810(4511(12)18)91315(20)17(16(23)2413)7614(19)212h458918H367H212H3b139
METHYL3((5Z)5((3ETHOXY4HYDROXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOATE
methyl3((5Z)5(3ethoxy4hydroxybenzylidene)4oxo2thioxo13thiazolidin3yl)propanoate
METHYL3(5((3ETHOXY4HYDROXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOATE
MFCD02225762
ZINC000013388688
ZINC13388688

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.