Vitas-M small molecule compound
(2E)-4-{[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]amino}-4-oxobut-2-enoic acid
Catalog ID
STK392251
SMILES CCOC(=O)c1c(NC(=O)/C=C/C(=O)O)sc(c1C)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 C13H15NO5S MW 297.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15NO5S/c1-4-19-13(18)11-7(2)8(3)20-12(11)14-9(15)5-6-10(16)17/h5-6H,4H2,1-3H3,(H,14,15)(H,16,17)/b6-5+InChIKey
BFTZHIBQBQWJNU-AATRIKPKSA-NSynonyms
295347-56-7(2E)3(N(3(ETHOXYCARBONYL)45DIMETHYL(2THIENYL))CARBAMOYL)PROP2ENOICACID
(2E)4((3(ethoxycarbonyl)45dimethylthiophen2yl)amino)4oxobut2enoicacid
(E)4((3(ethoxycarbonyl)45dimethylthiophen2yl)amino)4oxobut2enoicacid
(E)4((3ETHOXYCARBONYL45DIMETHYLTHIOPHEN2YL)AMINO)4OXOBUT2ENOICACID
295347567
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C=CC(=O)O
CCOC(=O)c1c(NC(=O)C=CC(=O)O)sc(c1C)C
InChI=1SC13H15NO5Sc141913(18)117(2)8(3)2012(11)149(15)5610(16)17h56H4H213H3(H1415)(H1617)b65+
MFCD00519026
ZINC000000046751
ZINC46751
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