Vitas-M small molecule compound
(5E)-5-(3-bromo-2-hydroxy-5-nitrobenzylidene)-3-(4-methoxybenzyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL419026
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C/c2cc(cc(c2O)Br)[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 C18H13BrN2O5S2 MW 481.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrN2O5S2/c1-26-13-4-2-10(3-5-13)9-20-17(23)15(28-18(20)27)7-11-6-12(21(24)25)8-14(19)16(11)22/h2-8,22H,9H2,1H3/b15-7+InChIKey
VUEMQGVJMUMEBM-VIZOYTHASA-NSynonyms
(5E)5((3BROMO2HYDROXY5NITROPHENYL)METHYLIDENE)3((4METHOXYPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(3bromo2hydroxy5nitrobenzylidene)3(4methoxybenzyl)2thioxo13thiazolidin4one
5((3BROMO2HYDROXY5NITROPHENYL)METHYLENE)3((4METHOXYPHENYL)METHYL)2THIOXO13THIAZOLIDIN4ONE
COC1=CC=C(C=C1)CN2C(=O)C(=CC3=CC(=CC(=C3O)Br)(N+)(=O)(O))SC2=S
COc1ccc(cc1)CN1C(=S)SC(=Cc2cc(cc(c2O)Br)(N+)(=O)(O))C1=O
InChI=1SC18H13BrN2O5S2c126134210(3513)92017(23)15(2818(20)27)711612(21(24)25)814(19)16(11)22h2822H9H21H3b157+
MFCD03546562
ZINC000013546269
ZINC13546269
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