Vitas-M small molecule compound
2-[(E)-(2-{[(1,3-benzodioxol-5-ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]-4,6-dibromophenyl 1,3-benzodioxole-5-carboxylate (non-preferred name)
Catalog ID
STK370379
SMILES O=C(CNC(=O)c1ccc2c(c1)OCO2)N/N=C/c1cc(Br)cc(c1OC(=O)c1ccc2c(c1)OCO2)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 C25H17Br2N3O8 MW 647.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17Br2N3O8/c26-16-5-15(23(17(27)8-16)38-25(33)14-2-4-19-21(7-14)37-12-35-19)9-29-30-22(31)10-28-24(32)13-1-3-18-20(6-13)36-11-34-18/h1-9H,10-12H2,(H,28,32)(H,30,31)/b29-9+InChIKey
XPADGXKECXZSOF-GESPGMLMSA-NSynonyms
(2((E)((2(13benzodioxole5carbonylamino)acetyl)hydrazinylidene)methyl)46dibromophenyl)13benzodioxole5carboxylate
2((1E)2(2(2HBENZO(D)13DIOXOLEN5YLCARBONYLAMINO)ACETYLAMINO)2AZAVINYL)46DIBROMOPHENYL2HBENZO(34D)13DIOXOLANE5CARBOXYLATE
2((E)(2(((13benzodioxol5ylcarbonyl)amino)acetyl)hydrazinylidene)methyl)46dibromophenyl13benzodioxole5carboxylate(nonpreferredname)
C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)NN=CC3=CC(=CC(=C3OC(=O)C4=CC5=C(C=C4)OCO5)Br)Br
InChI=1SC25H17Br2N3O8c2616515(23(17(27)816)3825(33)14241921(714)37123519)9293022(31)102824(32)13131820(613)36113418h19H1012H2(H2832)(H3031)b299+
MFCD00305104
O=C(CNC(=O)c1ccc2c(c1)OCO2)NN=Cc1cc(Br)cc(c1OC(=O)c1ccc2c(c1)OCO2)Br
ZINC000004018595
ZINC150645842
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.