Vitas-M small molecule compound

N-{4-[(3,4-dimethylphenyl)sulfamoyl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Catalog ID
STK026605
SMILES Cc1cc(ccc1C)NS(=O)(=O)c1ccc(cc1)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 C22H22N2O6S2 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O6S2/c1-15-3-4-18(13-16(15)2)24-31(25,26)19-7-5-17(6-8-19)23-32(27,28)20-9-10-21-22(14-20)30-12-11-29-21/h3-10,13-14,23-24H,11-12H2,1-2H3
InChIKey
CBPXBYIZWDREPA-UHFFFAOYSA-N
Synonyms
440108-05-4
(2H3HBENZO(34E)14DIOXAN6YLSULFONYL)(4(((34DIMETHYLPHENYL)AMINO)SULFONYL)PHENYL)AMINE
440108054
CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4)C
Cc1cc(ccc1C)NS(=O)(=O)c1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)OCCO2
InChI=1SC22H22N2O6S2c1153418(1316(15)2)2431(2526)197517(6819)2332(2728)209102122(1420)3012112921h31013142324H1112H212H3
MFCD03042825
N(4((34DIMETHYLANILINO)SULFONYL)PHENYL)23DIHYDRO14BENZODIOXINE6SULFONAMIDE
N(4((34DIMETHYLPHENYL)SULFAMOYL)PHENYL)23DIHYDRO14BENZODIOXINE6SULFONAMIDE
N(4(N(34DIMETHYLPHENYL)SULFAMOYL)PHENYL)23DIHYDROBENZO(B)(14)DIOXINE6SULFONAMIDE
STK026605
ZINC000000660540
ZINC00660540
ZINC660540

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Available files

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