Vitas-M small molecule compound

ethyl 2-[(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-ylcarbonyl)amino]-4-phenylthiophene-3-carboxylate

Catalog ID
STK770254
SMILES CCOC(=O)c1c(scc1c1ccccc1)NC(=O)c1scc2c1OCCO2

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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 C20H17NO5S2 MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO5S2/c1-2-24-20(23)15-13(12-6-4-3-5-7-12)10-28-19(15)21-18(22)17-16-14(11-27-17)25-8-9-26-16/h3-7,10-11H,2,8-9H2,1H3,(H,21,22)
InChIKey
MREYYQQKYHAMTF-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=C4C(=CS3)OCCO4
ethyl2((23dihydrothieno(34b)(14)dioxin5ylcarbonyl)amino)4phenylthiophene3carboxylate
ETHYL2(23DIHYDROTHIENO(34B)(14)DIOXINE5CARBONYLAMINO)4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC20H17NO5S2c122420(23)1513(126435712)102819(15)2118(22)171614(112717)25892616h371011H289H21H3(H2122)
MFCD03765905
ZINC000003622913
ZINC03622913
ZINC3622913

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Available files

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