Vitas-M small molecule compound

1-[(4-methylphenyl)sulfonyl]azepane

Catalog ID
STK414158
SMILES Cc1ccc(cc1)S(=O)(=O)N1CCCCCC1

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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 C13H19NO2S MW 253.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19NO2S/c1-12-6-8-13(9-7-12)17(15,16)14-10-4-2-3-5-11-14/h6-9H,2-5,10-11H2,1H3
InChIKey
WYGOYZNQMXVUEJ-UHFFFAOYSA-N
Synonyms
17721-45-8
((4METHYLPHENYL)SULFONYL)AZAPERHYDROEPINE
1((4methylphenyl)sulfonyl)azepane
1(4METHYLPHENYL)SULFONYLAZEPANE
1(PTOLYLSULFONYL)AZEPANE
17721458
1TOSYLHEXAHYDRO1HAZEPINE
CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2
InChI=1SC13H19NO2Sc1126813(9712)17(1516)141042351114h69H251011H21H3
MFCD00441934
ZINC000000132125
ZINC00132125
ZINC132125

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Available files

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