Vitas-M small molecule compound
5-bromo-2-({[4-(butan-2-yl)phenoxy]acetyl}amino)benzoic acid
Catalog ID
STK075284
SMILES CCC(c1ccc(cc1)OCC(=O)Nc1ccc(cc1C(=O)O)Br)C
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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 C19H20BrNO4 MW 406.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNO4/c1-3-12(2)13-4-7-15(8-5-13)25-11-18(22)21-17-9-6-14(20)10-16(17)19(23)24/h4-10,12H,3,11H2,1-2H3,(H,21,22)(H,23,24)InChIKey
UWXQYAXWSNBOTL-UHFFFAOYSA-NSynonyms
5BROMO2(((4(BUTAN2YL)PHENOXY)ACETYL)AMINO)BENZOICACID
5BROMO2((2(4BUTAN2YLPHENOXY)ACETYL)AMINO)BENZOICACID
CCC(C)C1=CC=C(C=C1)OCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O
CCC(c1ccc(cc1)OCC(=O)Nc1ccc(cc1C(=O)O)Br)C
InChI=1SC19H20BrNO4c1312(2)134715(8513)251118(22)21179614(20)1016(17)19(23)24h41012H311H212H3(H2122)(H2324)
MFCD01604647
STK075284
ZINC000004600292
ZINC000004600293
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