Vitas-M small molecule compound

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

Catalog ID
STK152407
SMILES CCOC(=O)CN1C(=O)S/C(=C\c2ccc(cc2)I)/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 C14H12INO4S MW 417.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12INO4S/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
QWRSJVIKXFRRSE-XFFZJAGNSA-N
Synonyms

CCOC(=O)CN1C(=O)C(=CC2=CC=C(C=C2)I)SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2ccc(cc2)I)C1=O
ETHYL((5Z)5(4IODOBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL2((5Z)5((4IODOPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC14H12INO4Sc122012(17)81613(18)11(2114(16)19)793510(15)649h37H28H21H3b117
MFCD06662863
ZINC000002992907
ZINC02992907
ZINC2992907

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Available files

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