Vitas-M small molecule compound
(2E)-4-{[5-ethyl-3-(methoxycarbonyl)thiophen-2-yl]amino}-4-oxobut-2-enoic acid
Catalog ID
STK299937
SMILES COC(=O)c1cc(sc1NC(=O)/C=C/C(=O)O)CC
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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 C12H13NO5S MW 283.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO5S/c1-3-7-6-8(12(17)18-2)11(19-7)13-9(14)4-5-10(15)16/h4-6H,3H2,1-2H3,(H,13,14)(H,15,16)/b5-4+InChIKey
SMAHHJJAXBRMEJ-SNAWJCMRSA-NSynonyms
444908-71-8(2E)4((5ethyl3(methoxycarbonyl)thiophen2yl)amino)4oxobut2enoicacid
(E)4((5ETHYL3METHOXYCARBONYLTHIOPHEN2YL)AMINO)4OXOBUT2ENOICACID
4((5ETHYL3(METHOXYCARBONYL)2THIENYL)AMINO)4OXO2BUTENOICACID
444908718
CCC1=CC(=C(S1)NC(=O)C=CC(=O)O)C(=O)OC
COC(=O)c1cc(sc1NC(=O)C=CC(=O)O)CC
InChI=1SC12H13NO5Sc13768(12(17)182)11(197)139(14)4510(15)16h46H3H212H3(H1314)(H1516)b54+
MFCD02176633
ZINC000000355480
ZINC355480
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