Vitas-M small molecule compound
2,4-dibromo-6-[(E)-{2-[(5-bromopyridin-3-yl)carbonyl]hydrazinylidene}methyl]phenyl 3,4,5-trimethoxybenzoate
Catalog ID
STK669798
SMILES COc1cc(cc(c1OC)OC)C(=O)Oc1c(/C=N/NC(=O)c2cncc(c2)Br)cc(cc1Br)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 C23H18Br3N3O6 MW 672.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18Br3N3O6/c1-32-18-6-12(7-19(33-2)21(18)34-3)23(31)35-20-13(4-15(24)8-17(20)26)10-28-29-22(30)14-5-16(25)11-27-9-14/h4-11H,1-3H3,(H,29,30)/b28-10+InChIKey
DSMROLPLZUWJLX-ORBVJSQLSA-NSynonyms
(24dibromo6((E)((5bromopyridine3carbonyl)hydrazinylidene)methyl)phenyl)345trimethoxybenzoate
24dibromo6((E)(2((5bromopyridin3yl)carbonyl)hydrazinylidene)methyl)phenyl345trimethoxybenzoate
COC1=CC(=CC(=C1OC)OC)C(=O)OC2=C(C=C(C=C2C=NNC(=O)C3=CC(=CN=C3)Br)Br)Br
COc1cc(cc(c1OC)OC)C(=O)Oc1c(C=NNC(=O)c2cncc(c2)Br)cc(cc1Br)Br
InChI=1SC23H18Br3N3O6c13218612(719(332)21(18)343)23(31)352013(415(24)817(20)26)10282922(30)14516(25)1127914h411H13H3(H2930)b2810+
MFCD00735961
ZINC000150349331
ZINC150640616
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