Vitas-M small molecule compound
3-{(E)-[2-({[(3,4,5-trimethoxyphenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}phenyl 2-bromobenzoate (non-preferred name)
Catalog ID
STK671990
SMILES COc1cc(cc(c1OC)OC)C(=O)NCC(=O)N/N=C/c1cccc(c1)OC(=O)c1ccccc1Br
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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 C26H24BrN3O7 MW 570.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24BrN3O7/c1-34-21-12-17(13-22(35-2)24(21)36-3)25(32)28-15-23(31)30-29-14-16-7-6-8-18(11-16)37-26(33)19-9-4-5-10-20(19)27/h4-14H,15H2,1-3H3,(H,28,32)(H,30,31)/b29-14+InChIKey
XEPMNFJDJNUSGD-IPPBACCNSA-NSynonyms
(3((E)((2((345trimethoxybenzoyl)amino)acetyl)hydrazinylidene)methyl)phenyl)2bromobenzoate
3((E)(2((((345trimethoxyphenyl)carbonyl)amino)acetyl)hydrazinylidene)methyl)phenyl2bromobenzoate(nonpreferredname)
COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)NN=CC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3Br
COc1cc(cc(c1OC)OC)C(=O)NCC(=O)NN=Cc1cccc(c1)OC(=O)c1ccccc1Br
InChI=1SC26H24BrN3O7c134211217(1322(352)24(21)363)25(32)281523(31)3029141676818(1116)3726(33)199451020(19)27h414H15H213H3(H2832)(H3031)b2914+
MFCD00822071
ZINC000098001667
ZINC102776775
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