Vitas-M small molecule compound

ethyl 4-({[(4-bromobenzyl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STK358200
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSCc1ccc(cc1)Br

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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 C18H18BrNO3S MW 408.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrNO3S/c1-2-23-18(22)14-5-9-16(10-6-14)20-17(21)12-24-11-13-3-7-15(19)8-4-13/h3-10H,2,11-12H2,1H3,(H,20,21)
InChIKey
HYENGNLOIWKXON-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)Br
ETHYL4((((4BROMOBENZYL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2((4BROMOPHENYL)METHYLSULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC18H18BrNO3Sc122318(22)145916(10614)2017(21)122411133715(19)8413h310H21112H21H3(H2021)
MFCD05996395
ZINC000001116623
ZINC01116623
ZINC1116623

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Available files

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