Vitas-M small molecule compound

2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl 3-methylthiophene-2-carboxylate

Catalog ID
STL014092
SMILES O=C(Nc1ccc2c(c1)OCCO2)COC(=O)c1sccc1C

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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 C16H15NO5S MW 333.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO5S/c1-10-4-7-23-15(10)16(19)22-9-14(18)17-11-2-3-12-13(8-11)21-6-5-20-12/h2-4,7-8H,5-6,9H2,1H3,(H,17,18)
InChIKey
NKEJZSLLWUTXPR-UHFFFAOYSA-N
Synonyms
805304-35-2
(2(23DIHYDRO14BENZODIOXIN6YLAMINO)2OXOETHYL)3METHYLTHIOPHENE2CARBOXYLATE
2(23dihydro14benzodioxin6ylamino)2oxoethyl3methylthiophene2carboxylate
805304352
CC1=C(SC=C1)C(=O)OCC(=O)NC2=CC3=C(C=C2)OCCO3
InChI=1SC16H15NO5Sc110472315(10)16(19)22914(18)1711231213(811)21652012h2478H569H21H3(H1718)
MFCD05300756
ZINC000005967164
ZINC05967164
ZINC5967164

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Available files

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