Vitas-M small molecule compound
3-{5-(4-bromophenyl)-1-[4-(ethoxycarbonyl)phenyl]-1H-pyrrol-2-yl}propanoic acid
Catalog ID
STK278323
SMILES CCOC(=O)c1ccc(cc1)n1c(CCC(=O)O)ccc1c1ccc(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 C22H20BrNO4 MW 442.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrNO4/c1-2-28-22(27)16-5-9-18(10-6-16)24-19(12-14-21(25)26)11-13-20(24)15-3-7-17(23)8-4-15/h3-11,13H,2,12,14H2,1H3,(H,25,26)InChIKey
NHVDPRSTVDGZQG-UHFFFAOYSA-NSynonyms
3(5(4bromophenyl)1(4(ethoxycarbonyl)phenyl)1Hpyrrol2yl)propanoicacid
3(5(4bromophenyl)1(4ethoxycarbonylphenyl)pyrrol2yl)propanoicacid
CCOC(=O)C1=CC=C(C=C1)N2C(=CC=C2C3=CC=C(C=C3)Br)CCC(=O)O
InChI=1SC22H20BrNO4c122822(27)165918(10616)2419(121421(25)26)111320(24)153717(23)8415h31113H21214H21H3(H2526)
MFCD03827347
ZINC000008590015
ZINC8590015
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