Vitas-M small molecule compound
(5Z)-5-{5-bromo-2-[(4-nitrobenzyl)oxy]benzylidene}-3-propyl-1,3-thiazolidine-2,4-dione
Catalog ID
STL296853
SMILES CCCN1C(=O)S/C(=C\c2cc(Br)ccc2OCc2ccc(cc2)[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 C20H17BrN2O5S MW 477.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrN2O5S/c1-2-9-22-19(24)18(29-20(22)25)11-14-10-15(21)5-8-17(14)28-12-13-3-6-16(7-4-13)23(26)27/h3-8,10-11H,2,9,12H2,1H3/b18-11-InChIKey
ZTHYOGAUPCXTCD-WQRHYEAKSA-NSynonyms
(5Z)5((5BROMO2((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)3PROPYL13THIAZOLIDINE24DIONE
(5Z)5(5bromo2((4nitrobenzyl)oxy)benzylidene)3propyl13thiazolidine24dione
CCCN1C(=O)C(=CC2=C(C=CC(=C2)Br)OCC3=CC=C(C=C3)(N+)(=O)(O))SC1=O
CCCN1C(=O)SC(=Cc2cc(Br)ccc2OCc2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC20H17BrN2O5Sc1292219(24)18(2920(22)25)11141015(21)5817(14)2812133616(7413)23(26)27h381011H2912H21H3b1811
MFCD03137754
ZINC000002828283
ZINC02828283
ZINC2828283
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