Vitas-M small molecule compound

3-[(3-butyl-2,4-dioxo-1,3-thiazolidin-5-yl)amino]benzoic acid

Catalog ID
STL257806
SMILES CCCCN1C(=O)SC(C1=O)Nc1cccc(c1)C(=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 C14H16N2O4S MW 308.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O4S/c1-2-3-7-16-12(17)11(21-14(16)20)15-10-6-4-5-9(8-10)13(18)19/h4-6,8,11,15H,2-3,7H2,1H3,(H,18,19)
InChIKey
MTQKVXNCXYJPHN-UHFFFAOYSA-N
Synonyms

3((3butyl24dioxo13thiazolidin5yl)amino)benzoicacid
CCCCN1C(=O)C(SC1=O)NC2=CC=CC(=C2)C(=O)O
InChI=1SC14H16N2O4Sc12371612(17)11(2114(16)20)15106459(810)13(18)19h4681115H237H21H3(H1819)
MFCD06644241
ZINC000012113071
ZINC000012113072

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Available files

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