Vitas-M small molecule compound
(5Z)-5-{3-iodo-5-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-3-(2-methylpropyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL364687
SMILES COc1cc(/C=C/2\SC(=O)N(C2=O)CC(C)C)cc(c1OCc1ccc(cc1)[N+](=O)[O-])I
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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 C22H21IN2O6S MW 568.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21IN2O6S/c1-13(2)11-24-21(26)19(32-22(24)27)10-15-8-17(23)20(18(9-15)30-3)31-12-14-4-6-16(7-5-14)25(28)29/h4-10,13H,11-12H2,1-3H3/b19-10-InChIKey
WVKHRYWXZMXQCI-GRSHGNNSSA-NSynonyms
(5Z)5((3iodo5methoxy4((4nitrophenyl)methoxy)phenyl)methylidene)3(2methylpropyl)13thiazolidine24dione
(5Z)5(3iodo5methoxy4((4nitrobenzyl)oxy)benzylidene)3(2methylpropyl)13thiazolidine24dione
CC(C)CN1C(=O)C(=CC2=CC(=C(C(=C2)I)OCC3=CC=C(C=C3)(N+)(=O)(O))OC)SC1=O
COc1cc(C=C2SC(=O)N(C2=O)CC(C)C)cc(c1OCc1ccc(cc1)(N+)(=O)(O))I
InChI=1SC22H21IN2O6Sc113(2)112421(26)19(3222(24)27)1015817(23)20(18(915)303)3112144616(7514)25(28)29h41013H1112H213H3b1910
MFCD09426459
ZINC000105958863
ZINC105958863
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