Vitas-M small molecule compound
2-bromo-4-[(Z)-2-cyano-2-(4-nitrophenyl)ethenyl]-6-methoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STK036870
SMILES COc1cc(/C=C(/c2ccc(cc2)[N+](=O)[O-])\C#N)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 C23H17BrN2O6S MW 529.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17BrN2O6S/c1-15-3-9-20(10-4-15)33(29,30)32-23-21(24)12-16(13-22(23)31-2)11-18(14-25)17-5-7-19(8-6-17)26(27)28/h3-13H,1-2H3/b18-11+InChIKey
IQRQLWXWCRKCSG-WOJGMQOQSA-NSynonyms
(2BROMO4((Z)2CYANO2(4NITROPHENYL)ETHENYL)6METHOXYPHENYL)4METHYLBENZENESULFONATE
(Z)2bromo4(2cyano2(4nitrophenyl)vinyl)6methoxyphenyl4methylbenzenesulfonate
2BROMO4((Z)2CYANO2(4NITROPHENYL)ETHENYL)6METHOXYPHENYL4METHYLBENZENESULFONATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C=C(C#N)C3=CC=C(C=C3)(N+)(=O)(O))OC
COc1cc(C=C(c2ccc(cc2)(N+)(=O)(O))C#N)cc(c1OS(=O)(=O)c1ccc(cc1)C)Br
InChI=1SC23H17BrN2O6Sc1153920(10415)33(2930)322321(24)1216(1322(23)312)1118(1425)175719(8617)26(27)28h313H12H3b1811+
MFCD02993951
STK036870
ZINC000002301520
ZINC2301520
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