Vitas-M small molecule compound

ethyl [(5E)-5-(4-bromobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Catalog ID
STK152400
SMILES CCOC(=O)CN1C(=O)S/C(=C/c2ccc(cc2)Br)/C1=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 C14H12BrNO4S MW 370.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrNO4S/c1-2-20-12(17)8-16-13(18)11(21-14(16)19)7-9-3-5-10(15)6-4-9/h3-7H,2,8H2,1H3/b11-7+
InChIKey
XFMWTRTVHLSCOQ-YRNVUSSQSA-N
Synonyms

CCOC(=O)CN1C(=O)C(=CC2=CC=C(C=C2)Br)SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2ccc(cc2)Br)C1=O
ETHYL((5E)5(4BROMOBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL2((5E)5((4BROMOPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC14H12BrNO4Sc122012(17)81613(18)11(2114(16)19)793510(15)649h37H28H21H3b117+
MFCD03706071
ZINC000004694770
ZINC04694770
ZINC4694770

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Available files

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