Vitas-M small molecule compound
(5Z)-5-{3-bromo-4-[(4-chlorobenzyl)oxy]-5-ethoxybenzylidene}-3-(4-ethoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL378837
SMILES CCOc1cc(/C=C/2\SC(=S)N(C2=O)c2ccc(cc2)OCC)cc(c1OCc1ccc(cc1)Cl)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 C27H23BrClNO4S2 MW 604.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrClNO4S2/c1-3-32-21-11-9-20(10-12-21)30-26(31)24(36-27(30)35)15-18-13-22(28)25(23(14-18)33-4-2)34-16-17-5-7-19(29)8-6-17/h5-15H,3-4,16H2,1-2H3/b24-15-InChIKey
ROZJTCFFWZHBHC-IWIPYMOSSA-NSynonyms
(5Z)5((3bromo4((4chlorophenyl)methoxy)5ethoxyphenyl)methylidene)3(4ethoxyphenyl)2sulfanylidene13thiazolidin4one
(5Z)5(3bromo4((4chlorobenzyl)oxy)5ethoxybenzylidene)3(4ethoxyphenyl)2thioxo13thiazolidin4one
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)OCC4=CC=C(C=C4)Cl)OCC)SC2=S
CCOc1cc(C=C2SC(=S)N(C2=O)c2ccc(cc2)OCC)cc(c1OCc1ccc(cc1)Cl)Br
InChI=1SC27H23BrClNO4S2c13322111920(101221)3026(31)24(3627(30)35)15181322(28)25(23(1418)3342)3416175719(29)8617h515H3416H212H3b2415
MFCD28950989
ZINC000105979225
ZINC105979225
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