Vitas-M small molecule compound
[(5E)-5-(3-bromo-4-hydroxy-5-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK011741
SMILES COc1cc(/C=C\2/SC(=S)N(C2=O)CC(=O)O)cc(c1O)Br
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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 C13H10BrNO5S2 MW 404.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10BrNO5S2/c1-20-8-3-6(2-7(14)11(8)18)4-9-12(19)15(5-10(16)17)13(21)22-9/h2-4,18H,5H2,1H3,(H,16,17)/b9-4+InChIKey
DSTMPHJEFHUXQE-RUDMXATFSA-NSynonyms
((5E)5(3BROMO4HYDROXY5METHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
2((5E)5((3bromo4hydroxy5methoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
2(5((3BROMO4HYDROXY5METHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)Br)O
COc1cc(C=C2SC(=S)N(C2=O)CC(=O)O)cc(c1O)Br
InChI=1SC13H10BrNO5S2c120836(27(14)11(8)18)4912(19)15(510(16)17)13(21)229h2418H5H21H3(H1617)b94+
MFCD01870790
STK011741
ZINC000000967115
ZINC967115
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