Vitas-M small molecule compound

4-[(E)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 2-bromobenzoate

Catalog ID
STK201818
SMILES COc1cc(ccc1OC(=O)c1ccccc1Br)/C=C\1/SC(=O)NC1=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 C18H12BrNO5S MW 434.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrNO5S/c1-24-14-8-10(9-15-16(21)20-18(23)26-15)6-7-13(14)25-17(22)11-4-2-3-5-12(11)19/h2-9H,1H3,(H,20,21,23)/b15-9+
InChIKey
MLKCBOFVPVJAJT-OQLLNIDSSA-N
Synonyms

(4((E)(24dioxo13thiazolidin5ylidene)methyl)2methoxyphenyl)2bromobenzoate
4((E)(24dioxo13thiazolidin5ylidene)methyl)2methoxyphenyl2bromobenzoate
COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)S2)OC(=O)C3=CC=CC=C3Br
COc1cc(ccc1OC(=O)c1ccccc1Br)C=C1SC(=O)NC1=O
InChI=1SC18H12BrNO5Sc12414810(91516(21)2018(23)2615)6713(14)2517(22)11423512(11)19h29H1H3(H202123)b159+
MFCD05853985
ZINC000009944296
ZINC09944296
ZINC9944296

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Available files

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