Vitas-M small molecule compound

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

Catalog ID
STK426153
SMILES COC(=O)c1c(NC(=O)CCCOc2ccc(cc2Cl)Cl)sc(c1C)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 C19H19Cl2NO6S MW 460.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19Cl2NO6S/c1-10-15(18(24)26-2)17(29-16(10)19(25)27-3)22-14(23)5-4-8-28-13-7-6-11(20)9-12(13)21/h6-7,9H,4-5,8H2,1-3H3,(H,22,23)
InChIKey
WNLGSYDRBBCNOH-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)C(=O)OC
dimethyl5((4(24dichlorophenoxy)butanoyl)amino)3methylthiophene24dicarboxylate
DIMETHYL5(4(24DICHLOROPHENOXY)BUTANOYLAMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC19H19Cl2NO6Sc11015(18(24)262)17(2916(10)19(25)273)2214(23)54828137611(20)912(13)21h679H458H213H3(H2223)
METHYL2(4(24DICHLOROPHENOXY)BUTANOYLAMINO)5(METHOXYCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD01339058
ZINC000002736257
ZINC02736257
ZINC2736257

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Available files

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