Vitas-M small molecule compound
2,4-dibromo-6-{(E)-[2-({[(3,4-dimethoxyphenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}phenyl 2-bromobenzoate (non-preferred name)
Catalog ID
STK672463
SMILES COc1ccc(cc1OC)C(=O)NCC(=O)N/N=C/c1cc(Br)cc(c1OC(=O)c1ccccc1Br)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 C25H20Br3N3O6 MW 698.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20Br3N3O6/c1-35-20-8-7-14(10-21(20)36-2)24(33)29-13-22(32)31-30-12-15-9-16(26)11-19(28)23(15)37-25(34)17-5-3-4-6-18(17)27/h3-12H,13H2,1-2H3,(H,29,33)(H,31,32)/b30-12+InChIKey
DJLDNTOADUHLBS-PNQUVVCRSA-NSynonyms
(24dibromo6((E)((2((34dimethoxybenzoyl)amino)acetyl)hydrazinylidene)methyl)phenyl)2bromobenzoate
24dibromo6((E)(2((((34dimethoxyphenyl)carbonyl)amino)acetyl)hydrazinylidene)methyl)phenyl2bromobenzoate(nonpreferredname)
COC1=C(C=C(C=C1)C(=O)NCC(=O)NN=CC2=CC(=CC(=C2OC(=O)C3=CC=CC=C3Br)Br)Br)OC
COc1ccc(cc1OC)C(=O)NCC(=O)NN=Cc1cc(Br)cc(c1OC(=O)c1ccccc1Br)Br
InChI=1SC25H20Br3N3O6c135208714(1021(20)362)24(33)291322(32)31301215916(26)1119(28)23(15)3725(34)17534618(17)27h312H13H212H3(H2933)(H3132)b3012+
MFCD00824211
ZINC000098001740
ZINC150556834
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