Vitas-M small molecule compound
ethyl 2-{[(2E)-4-amino-4-oxobut-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STL019571
SMILES CCOC(=O)c1c(NC(=O)/C=C/C(=O)N)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 C13H16N2O4S MW 296.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O4S/c1-4-19-13(18)11-7(2)8(3)20-12(11)15-10(17)6-5-9(14)16/h5-6H,4H2,1-3H3,(H2,14,16)(H,15,17)/b6-5+InChIKey
PHQAHULBLGKQQG-AATRIKPKSA-NSynonyms
302804-43-9302804439
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C=CC(=O)N
CCOC(=O)c1c(NC(=O)C=CC(=O)N)sc(c1C)C
ethyl2(((2E)4amino4oxobut2enoyl)amino)45dimethylthiophene3carboxylate
ETHYL2(((E)4AMINO4OXOBUT2ENOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ETHYL2((2E)3CARBAMOYLPROP2ENOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
InChI=1SC13H16N2O4Sc141913(18)117(2)8(3)2012(11)1510(17)659(14)16h56H4H213H3(H21416)(H1517)b65+
MFCD01848156
ZINC000000118792
ZINC000102961817
ZINC00118792
ZINC118792
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