Vitas-M small molecule compound
2-cyanobenzyl 2-chloro-5-{5-[(E)-2-(8-hydroxy-7-nitro[1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethenyl]furan-2-yl}benzoate
Catalog ID
STL376739
SMILES N#Cc1ccccc1COC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C/c1nn2cnnc2c(c1[N+](=O)[O-])O
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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 C26H15ClN6O6 MW 542.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H15ClN6O6/c27-20-8-5-15(11-19(20)26(35)38-13-17-4-2-1-3-16(17)12-28)22-10-7-18(39-22)6-9-21-23(33(36)37)24(34)25-30-29-14-32(25)31-21/h1-11,14,34H,13H2/b9-6+InChIKey
GCXXGAJAEUNEOE-RMKNXTFCSA-NSynonyms
2cyanobenzyl2chloro5(5((E)2(8hydroxy7nitro(124)triazolo(43b)pyridazin6yl)ethenyl)furan2yl)benzoate
MFCD07065555
N#Cc1ccccc1COC(=O)c1cc(ccc1Cl)c1ccc(o1)C=Cc1nn2cnnc2c(c1(N+)(=O)(O))O
ZINC000100167805
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