Vitas-M small molecule compound
(5E)-5-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzylidene}-3-(3-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK152902
SMILES CCOc1cc(/C=C\2/SC(=O)N(C2=O)Cc2cccc(c2)[N+](=O)[O-])cc(c1OCc1ccccc1Cl)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 C26H20BrClN2O6S MW 603.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20BrClN2O6S/c1-2-35-22-12-17(11-20(27)24(22)36-15-18-7-3-4-9-21(18)28)13-23-25(31)29(26(32)37-23)14-16-6-5-8-19(10-16)30(33)34/h3-13H,2,14-15H2,1H3/b23-13+InChIKey
CNQBNUZONADGHI-YDZHTSKRSA-NSynonyms
(5E)5((3bromo4((2chlorophenyl)methoxy)5ethoxyphenyl)methylidene)3((3nitrophenyl)methyl)13thiazolidine24dione
(5E)5(3BROMO4((2CHLOROBENZYL)OXY)5ETHOXYBENZYLIDENE)3(3NITROBENZYL)13THIAZOLIDINE24DIONE
5(3BROMO4((2CHLOROBENZYL)OXY)5ETHOXYBENZYLIDENE)3(3NITROBENZYL)13THIAZOLIDINE24DIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC(=CC=C3)(N+)(=O)(O))Br)OCC4=CC=CC=C4Cl
CCOc1cc(C=C2SC(=O)N(C2=O)Cc2cccc(c2)(N+)(=O)(O))cc(c1OCc1ccccc1Cl)Br
InChI=1SC26H20BrClN2O6Sc1235221217(1120(27)24(22)361518734921(18)28)132325(31)29(26(32)3723)141665819(1016)30(33)34h313H21415H21H3b2313+
MFCD03696576
ZINC000008383944
ZINC08383944
ZINC8383944
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