Vitas-M small molecule compound
(5Z)-3-(2-ethylhexyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK822474
SMILES CCCCC(CN1C(=S)S/C(=C\c2ccc(cc2)[N+](=O)[O-])/C1=O)CC
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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 C18H22N2O3S2 MW 378.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O3S2/c1-3-5-6-13(4-2)12-19-17(21)16(25-18(19)24)11-14-7-9-15(10-8-14)20(22)23/h7-11,13H,3-6,12H2,1-2H3/b16-11-InChIKey
AGDDRFBAWFPXJI-WJDWOHSUSA-NSynonyms
(5Z)3(2ETHYLHEXYL)5((4NITROPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(2ethylhexyl)5(4nitrobenzylidene)2thioxo13thiazolidin4one
CCCCC(CC)CN1C(=O)C(=CC2=CC=C(C=C2)(N+)(=O)(O))SC1=S
CCCCC(CN1C(=S)SC(=Cc2ccc(cc2)(N+)(=O)(O))C1=O)CC
InChI=1SC18H22N2O3S2c135613(42)121917(21)16(2518(19)24)11147915(10814)20(22)23h71113H3612H212H3b1611
MFCD03139187
ZINC000002891827
ZINC000002891829
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