Vitas-M small molecule compound

2-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoic acid

Catalog ID
STK994047
SMILES CC(C(N1C(=S)S/C(=C/c2ccco2)/C1=O)C(=O)O)C

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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 C13H13NO4S2 MW 311.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO4S2/c1-7(2)10(12(16)17)14-11(15)9(20-13(14)19)6-8-4-3-5-18-8/h3-7,10H,1-2H3,(H,16,17)/b9-6+
InChIKey
UOZIGPIGTJKAOO-RMKNXTFCSA-N
Synonyms

2((5E)5(FURAN2YLMETHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)3METHYLBUTANOICACID
2((5E)5(furan2ylmethylidene)4oxo2thioxo13thiazolidin3yl)3methylbutanoicacid
2(5(2FURYLMETHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))3METHYLBUTANOICACID
CC(C(N1C(=S)SC(=Cc2ccco2)C1=O)C(=O)O)C
CC(C)C(C(=O)O)N1C(=O)C(=CC2=CC=CO2)SC1=S
InChI=1SC13H13NO4S2c17(2)10(12(16)17)1411(15)9(2013(14)19)68435188h3710H12H3(H1617)b96+
MFCD01831133
ZINC000005123803
ZINC000005123804

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Available files

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