Vitas-M small molecule compound
methyl 2-{[(2E)-3-(5-bromofuran-2-yl)-2-cyanoprop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK731826
SMILES N#C/C(=C\c1ccc(o1)Br)/C(=O)Nc1sc(c(c1C(=O)OC)C)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 C16H13BrN2O4S MW 409.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN2O4S/c1-8-9(2)24-15(13(8)16(21)22-3)19-14(20)10(7-18)6-11-4-5-12(17)23-11/h4-6H,1-3H3,(H,19,20)/b10-6+InChIKey
QYSKLRLNPQRGCP-UXBLZVDNSA-NSynonyms
501351-47-9(E)methyl2(3(5bromofuran2yl)2cyanoacrylamido)45dimethylthiophene3carboxylate
501351479
CC1=C(SC(=C1C(=O)OC)NC(=O)C(=CC2=CC=C(O2)Br)C#N)C
InChI=1SC16H13BrN2O4Sc189(2)2415(13(8)16(21)223)1914(20)10(718)6114512(17)2311h46H13H3(H1920)b106+
methyl2(((2E)3(5bromofuran2yl)2cyanoprop2enoyl)amino)45dimethylthiophene3carboxylate
METHYL2(((E)3(5BROMOFURAN2YL)2CYANOPROP2ENOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD03620592
N#CC(=Cc1ccc(o1)Br)C(=O)Nc1sc(c(c1C(=O)OC)C)C
ZINC000005186436
ZINC05186436
ZINC5186436
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