Vitas-M small molecule compound

ethyl 1-[(6-methyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)sulfonyl]piperidine-4-carboxylate

Catalog ID
STL433030
SMILES CCOC(=O)C1CCN(CC1)S(=O)(=O)c1cc2[nH]c(=O)[nH]c2cc1C

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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 C16H21N3O5S MW 367.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O5S/c1-3-24-15(20)11-4-6-19(7-5-11)25(22,23)14-9-13-12(8-10(14)2)17-16(21)18-13/h8-9,11H,3-7H2,1-2H3,(H2,17,18,21)
InChIKey
DZNUCWFKZMFVOK-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1CCN(CC1)S(=O)(=O)c1cc2(nH)c(=O)(nH)c2cc1C
CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2C)NC(=O)N3
ethyl1((6methyl2oxo13dihydrobenzimidazol5yl)sulfonyl)piperidine4carboxylate
ethyl1((6methyl2oxo23dihydro1Hbenzimidazol5yl)sulfonyl)piperidine4carboxylate
InChI=1SC16H21N3O5Sc132415(20)114619(7511)25(2223)1491312(810(14)2)1716(21)1813h8911H37H212H3(H2171821)
MFCD09039410
ZINC000013364751
ZINC13364751

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Available files

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