Vitas-M small molecule compound

ethyl 4-(2,3-dihydro-1,4-benzodioxin-2-yl)-2-[(furan-2-ylcarbonyl)amino]thiophene-3-carboxylate

Catalog ID
STK059989
SMILES CCOC(=O)c1c(scc1C1COc2c(O1)cccc2)NC(=O)c1ccco1

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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 C20H17NO6S MW 399.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO6S/c1-2-24-20(23)17-12(16-10-26-13-6-3-4-7-14(13)27-16)11-28-19(17)21-18(22)15-8-5-9-25-15/h3-9,11,16H,2,10H2,1H3,(H,21,22)
InChIKey
NPZFKJTWPRNAMI-UHFFFAOYSA-N
Synonyms

4(23DIHYDRO14BENZODIOXIN3YL)2((2FURANYL(OXO)METHYL)AMINO)3THIOPHENECARBOXYLICACIDETHYLESTER
4(23DIHYDRO14BENZODIOXIN3YL)2(2FUROYLAMINO)THIOPHENE3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(SC=C1C2COC3=CC=CC=C3O2)NC(=O)C4=CC=CO4
CCOC(=O)c1c(scc1C1COc2c(O1)cccc2)NC(=O)c1ccco1
ETHYL4((2R)23DIHYDRO14BENZODIOXIN2YL)2((FURAN2YLCARBONYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL4(23DIHYDRO14BENZODIOXIN2YL)2((FURAN2YLCARBONYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL4(23DIHYDRO14BENZODIOXIN2YL)2(2FUROYLAMINO)3THIOPHENECARBOXYLATE
ETHYL4(23DIHYDRO14BENZODIOXIN3YL)2(FURAN2CARBONYLAMINO)THIOPHENE3CARBOXYLATE
ETHYL4(23DIHYDRO14BENZODIOXIN3YL)2(FURAN2YLCARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC20H17NO6Sc122420(23)1712(16102613634714(13)2716)112819(17)2118(22)158592515h391116H210H21H3(H2122)
MFCD02642356
STK059989
ZINC000002483728
ZINC000004196594

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Available files

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