Vitas-M small molecule compound

4-formyl-2-methoxyphenyl 1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate

Catalog ID
STL378855
SMILES O=Cc1ccc(c(c1)OC)OS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C

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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 C17H16N2O6S MW 376.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O6S/c1-18-13-6-5-12(9-14(13)19(2)17(18)21)26(22,23)25-15-7-4-11(10-20)8-16(15)24-3/h4-10H,1-3H3
InChIKey
RNJUQARLYBANHW-UHFFFAOYSA-N
Synonyms

(4FORMYL2METHOXYPHENYL)13DIMETHYL2OXOBENZIMIDAZOLE5SULFONATE
4formyl2methoxyphenyl13dimethyl2oxo23dihydro1Hbenzimidazole5sulfonate
CN1C2=C(C=C(C=C2)S(=O)(=O)OC3=C(C=C(C=C3)C=O)OC)N(C1=O)C
InChI=1SC17H16N2O6Sc118136512(914(13)19(2)17(18)21)26(2223)25157411(1020)816(15)243h410H13H3
MFCD03785181
ZINC000002163550
ZINC02163550
ZINC2163550

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Available files

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