Vitas-M small molecule compound

dimethyl 5-{[(3,4-diethoxyphenyl)acetyl]amino}-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK768600
SMILES CCOc1cc(ccc1OCC)CC(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)OC

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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 C21H25NO7S MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO7S/c1-6-28-14-9-8-13(10-15(14)29-7-2)11-16(23)22-19-17(20(24)26-4)12(3)18(30-19)21(25)27-5/h8-10H,6-7,11H2,1-5H3,(H,22,23)
InChIKey
CEXBWRNKSAOWKS-UHFFFAOYSA-N
Synonyms

CCOC1=C(C=C(C=C1)CC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC)OCC
dimethyl5(((34diethoxyphenyl)acetyl)amino)3methylthiophene24dicarboxylate
DIMETHYL5((2(34DIETHOXYPHENYL)ACETYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC21H25NO7Sc1628149813(1015(14)2972)1116(23)221917(20(24)264)12(3)18(3019)21(25)275h810H6711H215H3(H2223)
METHYL2(2(34DIETHOXYPHENYL)ACETYLAMINO)5(METHOXYCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03308269
ZINC000000720602
ZINC00720602
ZINC720602

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.