Vitas-M small molecule compound
4-[(E)-{2-[(2-bromo-4-chlorophenoxy)acetyl]hydrazinylidene}methyl]-2-methoxyphenyl 4-bromobenzoate
Catalog ID
STK667820
SMILES COc1cc(/C=N/NC(=O)COc2ccc(cc2Br)Cl)ccc1OC(=O)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 C23H17Br2ClN2O5 MW 596.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Br2ClN2O5/c1-31-21-10-14(2-8-20(21)33-23(30)15-3-5-16(24)6-4-15)12-27-28-22(29)13-32-19-9-7-17(26)11-18(19)25/h2-12H,13H2,1H3,(H,28,29)/b27-12+InChIKey
NNFTWYQATFRBPZ-KKMKTNMSSA-NSynonyms
(4((E)((2(2BROMO4CHLOROPHENOXY)ACETYL)HYDRAZINYLIDENE)METHYL)2METHOXYPHENYL)4BROMOBENZOATE
4((E)(2((2bromo4chlorophenoxy)acetyl)hydrazinylidene)methyl)2methoxyphenyl4bromobenzoate
COC1=C(C=CC(=C1)C=NNC(=O)COC2=C(C=C(C=C2)Cl)Br)OC(=O)C3=CC=C(C=C3)Br
COc1cc(C=NNC(=O)COc2ccc(cc2Br)Cl)ccc1OC(=O)c1ccc(cc1)Br
InChI=1SC23H17Br2ClN2O5c131211014(2820(21)3323(30)153516(24)6415)12272822(29)1332199717(26)1118(19)25h212H13H21H3(H2829)b2712+
MFCD18169436
ZINC000003087029
ZINC100042455
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