Vitas-M small molecule compound
4-{[(2E,5Z)-5-{3-bromo-5-ethoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid
Catalog ID
STK006805
SMILES CCOc1cc(/C=C/2\S/C(=N/c3ccc(cc3)C(=O)O)/N(C2=O)C)cc(c1OCc1ccc(cc1)[N+](=O)[O-])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 C27H22BrN3O7S MW 612.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22BrN3O7S/c1-3-37-22-13-17(12-21(28)24(22)38-15-16-4-10-20(11-5-16)31(35)36)14-23-25(32)30(2)27(39-23)29-19-8-6-18(7-9-19)26(33)34/h4-14H,3,15H2,1-2H3,(H,33,34)/b23-14-,29-27+InChIKey
QCIUSSHSNAFRTO-SLOBHAQXSA-NSynonyms
4(((2E5Z)5(3bromo5ethoxy4((4nitrobenzyl)oxy)benzylidene)3methyl4oxo13thiazolidin2ylidene)amino)benzoicacid
CCOc1cc(C=C2SC(=Nc3ccc(cc3)C(=O)O)N(C2=O)C)cc(c1OCc1ccc(cc1)(N+)(=O)(O))Br
MFCD02229703
STK006805
ZINC000100215559
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