Vitas-M small molecule compound

ethyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-5-(cyclohexylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK403254
SMILES CCOC(=O)c1c(NC(=O)c2ccc3c(c2)OCO3)sc(c1C)C(=O)NC1CCCCC1

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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 C23H26N2O6S MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O6S/c1-3-29-23(28)18-13(2)19(21(27)24-15-7-5-4-6-8-15)32-22(18)25-20(26)14-9-10-16-17(11-14)31-12-30-16/h9-11,15H,3-8,12H2,1-2H3,(H,24,27)(H,25,26)
InChIKey
UTHNTZGITGQRJC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2CCCCC2)NC(=O)C3=CC4=C(C=C3)OCO4
ethyl2((13benzodioxol5ylcarbonyl)amino)5(cyclohexylcarbamoyl)4methylthiophene3carboxylate
ETHYL2(13BENZODIOXOLE5CARBONYLAMINO)5(CYCLOHEXYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H26N2O6Sc132923(28)1813(2)19(21(27)24157546815)3222(18)2520(26)149101617(1114)31123016h91115H3812H212H3(H2427)(H2526)
MFCD03312488
ZINC000001434672
ZINC01434672
ZINC1434672

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Available files

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