Vitas-M small molecule compound

(2Z)-4-{[3-(ethoxycarbonyl)thiophen-2-yl]amino}-4-oxobut-2-enoic acid

Catalog ID
STL020830
SMILES CCOC(=O)c1ccsc1NC(=O)/C=C\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 C11H11NO5S MW 269.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11NO5S/c1-2-17-11(16)7-5-6-18-10(7)12-8(13)3-4-9(14)15/h3-6H,2H2,1H3,(H,12,13)(H,14,15)/b4-3-
InChIKey
KYSNNRRHXAGRIK-ARJAWSKDSA-N
Synonyms
883279-74-1
(2Z)4((3(ethoxycarbonyl)thiophen2yl)amino)4oxobut2enoicacid
(Z)4((3ethoxycarbonylthiophen2yl)amino)4oxobut2enoicacid
883279741
CCOC(=O)C1=C(SC=C1)NC(=O)C=CC(=O)O
CCOC(=O)c1ccsc1NC(=O)C=CC(=O)O
InChI=1SC11H11NO5Sc121711(16)7561810(7)128(13)349(14)15h36H2H21H3(H1213)(H1415)b43
MFCD07802116
ZINC000101130865
ZINC101130865

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Available files

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