Vitas-M small molecule compound
(2E)-4-{[3-(ethoxycarbonyl)-5-ethylthiophen-2-yl]amino}-4-oxobut-2-enoic acid
Catalog ID
STK423370
SMILES CCc1cc(c(s1)NC(=O)/C=C/C(=O)O)C(=O)OCC
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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 C13H15NO5S MW 297.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15NO5S/c1-3-8-7-9(13(18)19-4-2)12(20-8)14-10(15)5-6-11(16)17/h5-7H,3-4H2,1-2H3,(H,14,15)(H,16,17)/b6-5+InChIKey
CWRGTTCTYZKHMW-AATRIKPKSA-NSynonyms
(2E)3(N(3(ETHOXYCARBONYL)5ETHYL(2THIENYL))CARBAMOYL)PROP2ENOICACID
(2E)4((3(ethoxycarbonyl)5ethylthiophen2yl)amino)4oxobut2enoicacid
(E)4((3ETHOXYCARBONYL5ETHYLTHIOPHEN2YL)AMINO)4OXOBUT2ENOICACID
CCC1=CC(=C(S1)NC(=O)C=CC(=O)O)C(=O)OCC
CCc1cc(c(s1)NC(=O)C=CC(=O)O)C(=O)OCC
InChI=1SC13H15NO5Sc13879(13(18)1942)12(208)1410(15)5611(16)17h57H34H212H3(H1415)(H1617)b65+
MFCD00107458
ZINC000002151848
ZINC2151848
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