Vitas-M small molecule compound
2-bromo-6-ethoxy-4-{(E)-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]methyl}phenyl 4-methylbenzenesulfonate
Catalog ID
STK093979
SMILES CCOc1cc(/C=N/NC(=O)c2ccncc2)cc(c1OS(=O)(=O)c1ccc(cc1)C)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 C22H20BrN3O5S MW 518.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O5S/c1-3-30-20-13-16(14-25-26-22(27)17-8-10-24-11-9-17)12-19(23)21(20)31-32(28,29)18-6-4-15(2)5-7-18/h4-14H,3H2,1-2H3,(H,26,27)/b25-14+InChIKey
YYHZMMABQMRUOU-AFUMVMLFSA-NSynonyms
(2BROMO6ETHOXY4((E)(PYRIDINE4CARBONYLHYDRAZINYLIDENE)METHYL)PHENYL)4METHYLBENZENESULFONATE
2BROMO6ETHOXY4((E)(2(PYRIDIN4YLCARBONYL)HYDRAZINYLIDENE)METHYL)PHENYL4METHYLBENZENESULFONATE
CCOC1=C(C(=CC(=C1)C=NNC(=O)C2=CC=NC=C2)Br)OS(=O)(=O)C3=CC=C(C=C3)C
CCOc1cc(C=NNC(=O)c2ccncc2)cc(c1OS(=O)(=O)c1ccc(cc1)C)Br
InChI=1SC22H20BrN3O5Sc1330201316(14252622(27)178102411917)1219(23)21(20)3132(2829)186415(2)5718h414H3H212H3(H2627)b2514+
MFCD02952533
STK093979
ZINC000002149547
ZINC33349103
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