Vitas-M small molecule compound
(5Z)-3-(3,4-dimethylphenyl)-5-{3-[(4-nitrobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL416974
SMILES S=C1S/C(=C\c2cccc(c2)OCc2ccc(cc2)[N+](=O)[O-])/C(=O)N1c1ccc(c(c1)C)C
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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 C25H20N2O4S2 MW 476.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O4S2/c1-16-6-9-21(12-17(16)2)26-24(28)23(33-25(26)32)14-19-4-3-5-22(13-19)31-15-18-7-10-20(11-8-18)27(29)30/h3-14H,15H2,1-2H3/b23-14-InChIKey
YIILTVDPHNEJIJ-UCQKPKSFSA-NSynonyms
(5Z)3(34dimethylphenyl)5((3((4nitrophenyl)methoxy)phenyl)methylidene)2sulfanylidene13thiazolidin4one
(5Z)3(34dimethylphenyl)5(3((4nitrobenzyl)oxy)benzylidene)2thioxo13thiazolidin4one
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=CC=C3)OCC4=CC=C(C=C4)(N+)(=O)(O))SC2=S)C
InChI=1SC25H20N2O4S2c1166921(1217(16)2)2624(28)23(3325(26)32)141943522(1319)31151871020(11818)27(29)30h314H15H212H3b2314
MFCD30707102
S=C1SC(=Cc2cccc(c2)OCc2ccc(cc2)(N+)(=O)(O))C(=O)N1c1ccc(c(c1)C)C
ZINC000108845176
ZINC108845176
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