Vitas-M small molecule compound

ethyl 2-{(5E)-5-[(5-iodofuran-2-yl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate

Catalog ID
STK178138
SMILES CCOC(=O)C(N1C(=O)S/C(=C/c2ccc(o2)I)/C1=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 C13H12INO5S MW 421.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12INO5S/c1-3-19-12(17)7(2)15-11(16)9(21-13(15)18)6-8-4-5-10(14)20-8/h4-7H,3H2,1-2H3/b9-6+
InChIKey
UEMFYCMHGWFTHD-RMKNXTFCSA-N
Synonyms

CCOC(=O)C(C)N1C(=O)C(=CC2=CC=C(O2)I)SC1=O
CCOC(=O)C(N1C(=O)SC(=Cc2ccc(o2)I)C1=O)C
ETHYL2((5E)5((5IODOFURAN2YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
InChI=1SC13H12INO5Sc131912(17)7(2)1511(16)9(2113(15)18)684510(14)208h47H3H212H3b96+
MFCD03698806
ZINC000009260987
ZINC000009260990

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Available files

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