Vitas-M small molecule compound

1-[(2,3,5,6-tetramethylphenyl)sulfonyl]azepane

Catalog ID
STK982107
SMILES Cc1c(C)cc(c(c1S(=O)(=O)N1CCCCCC1)C)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 C16H25NO2S MW 295.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H25NO2S/c1-12-11-13(2)15(4)16(14(12)3)20(18,19)17-9-7-5-6-8-10-17/h11H,5-10H2,1-4H3
InChIKey
SDBWJDMCQNKOAT-UHFFFAOYSA-N
Synonyms
835888-65-8
1((2356tetramethylphenyl)sulfonyl)azepane
1(2356tetramethylphenyl)sulfonylazepane
835888658
CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCCCCC2)C)C
InChI=1SC16H25NO2Sc1121113(2)15(4)16(14(12)3)20(1819)17975681017h11H510H214H3
MFCD05085174
ZINC000004810870
ZINC04810870
ZINC4810870

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Available files

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