Vitas-M small molecule compound
[(5Z)-5-(3,4-diethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STL427629
SMILES CCOc1cc(ccc1OCC)/C=C/1\SC(=S)N(C1=O)CC(=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 C16H17NO5S2 MW 367.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO5S2/c1-3-21-11-6-5-10(7-12(11)22-4-2)8-13-15(20)17(9-14(18)19)16(23)24-13/h5-8H,3-4,9H2,1-2H3,(H,18,19)/b13-8-InChIKey
QJTQDAZADRVUBD-JYRVWZFOSA-NSynonyms
((5Z)5(34diethoxybenzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5Z)5((34DIETHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2(5((34DIETHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
CCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)OCC
CCOc1cc(ccc1OCC)C=C1SC(=S)N(C1=O)CC(=O)O
InChI=1SC16H17NO5S2c1321116510(712(11)2242)81315(20)17(914(18)19)16(23)2413h58H349H212H3(H1819)b138
MFCD04064153
ZINC000016692867
ZINC16692867
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