Vitas-M small molecule compound
methyl 2-[({2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}acetyl)amino]benzoate
Catalog ID
STL091807
SMILES COC(=O)c1ccccc1NC(=O)Cn1cccc1c1onc(n1)c1ccc(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 C22H17BrN4O4 MW 481.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN4O4/c1-30-22(29)16-5-2-3-6-17(16)24-19(28)13-27-12-4-7-18(27)21-25-20(26-31-21)14-8-10-15(23)11-9-14/h2-12H,13H2,1H3,(H,24,28)InChIKey
XVZOWDXJTQMUSQ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1NC(=O)CN2C=CC=C2C3=NC(=NO3)C4=CC=C(C=C4)Br
InChI=1SC22H17BrN4O4c13022(29)16523617(16)2419(28)1327124718(27)212520(263121)1481015(23)11914h212H13H21H3(H2428)
methyl2(((2(3(4bromophenyl)124oxadiazol5yl)1Hpyrrol1yl)acetyl)amino)benzoate
methyl2((2(2(3(4bromophenyl)124oxadiazol5yl)pyrrol1yl)acetyl)amino)benzoate
MFCD18786203
ZINC000067207388
ZINC67207388
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