Vitas-M small molecule compound
2-(5-bromo-4-{(Z)-[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)-N-phenylacetamide
Catalog ID
STL172379
SMILES CCOc1cc(/C=C\2/C(=NN(C2=O)c2ccccc2Cl)C)c(cc1OCC(=O)Nc1ccccc1)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 C27H23BrClN3O4 MW 568.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrClN3O4/c1-3-35-24-14-18(13-20-17(2)31-32(27(20)34)23-12-8-7-11-22(23)29)21(28)15-25(24)36-16-26(33)30-19-9-5-4-6-10-19/h4-15H,3,16H2,1-2H3,(H,30,33)/b20-13-InChIKey
HZUCEVYMERYEFQ-MOSHPQCFSA-NSynonyms
834909-93-22(5bromo4((Z)(1(2chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)2ethoxyphenoxy)Nphenylacetamide
2(5bromo4((Z)(1(2chlorophenyl)3methyl5oxopyrazol4ylidene)methyl)2ethoxyphenoxy)Nphenylacetamide
834909932
CCOC1=C(C=C(C(=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3Cl)C)Br)OCC(=O)NC4=CC=CC=C4
CCOc1cc(C=C2C(=NN(C2=O)c2ccccc2Cl)C)c(cc1OCC(=O)Nc1ccccc1)Br
InChI=1SC27H23BrClN3O4c1335241418(132017(2)3132(27(20)34)2312871122(23)29)21(28)1525(24)361626(33)301995461019h415H316H212H3(H3033)b2013
MFCD02054519
ZINC000100225572
ZINC100225572
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