Vitas-M small molecule compound
4-[(E)-{2-[2-{[(2Z)-2-(4-{[(4-methoxyphenyl)carbonyl]oxy}benzylidene)hydrazinyl]carbonyl}-3-(4-nitrophenyl)acryloyl]hydrazinylidene}methyl]phenyl 4-methoxybenzoate
Catalog ID
STK669363
SMILES COc1ccc(cc1)C(=O)Oc1ccc(cc1)/C=N/NC(=O)/C(=C\c1ccc(cc1)[N+](=O)[O-])/C(=O)N/N=C\c1ccc(cc1)OC(=O)c1ccc(cc1)OC
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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 C40H31N5O10 MW 741.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H31N5O10/c1-52-32-19-9-29(10-20-32)39(48)54-34-15-5-27(6-16-34)24-41-43-37(46)36(23-26-3-13-31(14-4-26)45(50)51)38(47)44-42-25-28-7-17-35(18-8-28)55-40(49)30-11-21-33(53-2)22-12-30/h3-25H,1-2H3,(H,43,46)(H,44,47)/b36-23-,41-24-,42-25+InChIKey
BVHSQBUPZJEWHN-HWNLZBGTSA-NSynonyms
4((E)(2(2(((2Z)2(4(((4methoxyphenyl)carbonyl)oxy)benzylidene)hydrazinyl)carbonyl)3(4nitrophenyl)acryloyl)hydrazinylidene)methyl)phenyl4methoxybenzoate
COc1ccc(cc1)C(=O)Oc1ccc(cc1)C=NNC(=O)C(=Cc1ccc(cc1)(N+)(=O)(O))C(=O)NN=Cc1ccc(cc1)OC(=O)c1ccc(cc1)OC
MFCD00743347
ZINC000150348577
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