Vitas-M small molecule compound

methyl 3-[(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]-2-methylbenzoate

Catalog ID
STL222370
SMILES COC(=O)c1cccc(c1C)NS(=O)(=O)c1ccc2c(c1)OCCO2

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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 C17H17NO6S MW 363.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO6S/c1-11-13(17(19)22-2)4-3-5-14(11)18-25(20,21)12-6-7-15-16(10-12)24-9-8-23-15/h3-7,10,18H,8-9H2,1-2H3
InChIKey
DLLWLGPXOUZDSL-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C(=O)OC
InChI=1SC17H17NO6Sc11113(17(19)222)43514(11)1825(2021)12671516(1012)24982315h371018H89H212H3
methyl3((23dihydro14benzodioxin6ylsulfonyl)amino)2methylbenzoate
METHYL3(23DIHYDRO14BENZODIOXIN6YLSULFONYLAMINO)2METHYLBENZOATE
MFCD04141811
ZINC000000802886
ZINC00802886
ZINC802886

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Available files

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