Vitas-M small molecule compound

3,4,5-triethoxy-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]benzamide

Catalog ID
STK417390
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C

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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 C21H24N2O6S2 MW 464.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O6S2/c1-5-27-16-10-13(11-17(28-6-2)19(16)29-7-3)20(24)23-21-22-15-9-8-14(31(4,25)26)12-18(15)30-21/h8-12H,5-7H2,1-4H3,(H,22,23,24)
InChIKey
QGJMQISPMJIEQA-UHFFFAOYSA-N
Synonyms

345triethoxyN(6(methylsulfonyl)13benzothiazol2yl)benzamide
345TRIETHOXYN(6METHYLSULFONYL13BENZOTHIAZOL2YL)BENZAMIDE
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C
InChI=1SC21H24N2O6S2c1527161013(1117(2862)19(16)2973)20(24)232122159814(31(425)26)1218(15)3021h812H57H214H3(H222324)
MFCD01834979
ZINC000000998344
ZINC00998344
ZINC998344

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Available files

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