Vitas-M small molecule compound

3-[(5E)-5-(3-bromo-4-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid

Catalog ID
STL297103
SMILES COc1ccc(cc1Br)/C=C\1/SC(=S)N(C1=O)CCC(=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 C14H12BrNO4S2 MW 402.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrNO4S2/c1-20-10-3-2-8(6-9(10)15)7-11-13(19)16(14(21)22-11)5-4-12(17)18/h2-3,6-7H,4-5H2,1H3,(H,17,18)/b11-7+
InChIKey
KHUCIKRVCMDNPU-YRNVUSSQSA-N
Synonyms
305375-29-5
(E)3(5(3bromo4methoxybenzylidene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5E)5((3BROMO4METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
3((5E)5(3bromo4methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3(5((3BROMO4METHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOICACID
305375295
CHEMICALDIVERSITYLIBRARYCOMPOUND11
COC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)O)Br
COc1ccc(cc1Br)C=C1SC(=S)N(C1=O)CCC(=O)O
InChI=1SC14H12BrNO4S2c12010328(69(10)15)71113(19)16(14(21)2211)5412(17)18h2367H45H21H3(H1718)b117+
MFCD01912286
ZINC000000967020
ZINC967020

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Available files

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