Vitas-M small molecule compound

1-(azepan-1-yl)-2-[(4-bromobenzyl)sulfanyl]ethanone

Catalog ID
STK357711
SMILES Brc1ccc(cc1)CSCC(=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 C15H20BrNOS MW 342.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20BrNOS/c16-14-7-5-13(6-8-14)11-19-12-15(18)17-9-3-1-2-4-10-17/h5-8H,1-4,9-12H2
InChIKey
SSCGGNDUUVIEMC-UHFFFAOYSA-N
Synonyms
1(AZEPAN1YL)2((4BROMOBENZYL)SULFANYL)ETHANONE
1(AZEPAN1YL)2((4BROMOPHENYL)METHYLSULFANYL)ETHANONE
C1CCCN(CC1)C(=O)CSCC2=CC=C(C=C2)Br
Registry IDs
MFCD06626307
ZINC000004813969
ZINC04813969
ZINC4813969

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Available files

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