Vitas-M small molecule compound
ethyl [(5Z)-5-{3-bromo-5-methoxy-4-[(3-nitrobenzyl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STK157134
SMILES CCOC(=O)CN1C(=O)S/C(=C\c2cc(Br)c(c(c2)OC)OCc2cccc(c2)[N+](=O)[O-])/C1=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 C22H19BrN2O8S MW 551.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN2O8S/c1-3-32-19(26)11-24-21(27)18(34-22(24)28)10-14-8-16(23)20(17(9-14)31-2)33-12-13-5-4-6-15(7-13)25(29)30/h4-10H,3,11-12H2,1-2H3/b18-10-InChIKey
GVZNCZXGFLUDCH-ZDLGFXPLSA-NSynonyms
CCOC(=O)CN1C(=O)C(=CC2=CC(=C(C(=C2)Br)OCC3=CC(=CC=C3)(N+)(=O)(O))OC)SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2cc(Br)c(c(c2)OC)OCc2cccc(c2)(N+)(=O)(O))C1=O
ETHYL((5Z)5(3BROMO5METHOXY4((3NITROBENZYL)OXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL2((5Z)5((3BROMO5METHOXY4((3NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC22H19BrN2O8Sc133219(26)112421(27)18(3422(24)28)1014816(23)20(17(914)312)33121354615(713)25(29)30h410H31112H212H3b1810
MFCD03226974
ZINC000100236951
ZINC100236951
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