Vitas-M small molecule compound
2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-(4-bromo-2-fluorophenyl)acetamide
Catalog ID
STK250010
SMILES O=C(Nc1ccc(cc1F)Br)COc1ccc(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 C20H22BrFN2O4S MW 485.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrFN2O4S/c21-15-5-10-19(18(22)13-15)23-20(25)14-28-16-6-8-17(9-7-16)29(26,27)24-11-3-1-2-4-12-24/h5-10,13H,1-4,11-12,14H2,(H,23,25)InChIKey
KSCOEYDBOUAZPA-UHFFFAOYSA-NSynonyms
2(4(azepan1ylsulfonyl)phenoxy)N(4bromo2fluorophenyl)acetamide
C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OCC(=O)NC3=C(C=C(C=C3)Br)F
InChI=1SC20H22BrFN2O4Sc211551019(18(22)1315)2320(25)1428166817(9716)29(2627)241131241224h51013H14111214H2(H2325)
MFCD08677479
ZINC000009668690
ZINC09668690
ZINC9668690
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