Vitas-M small molecule compound
(5E)-3-benzyl-5-{4-methoxy-3-[(4-nitrobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL364901
SMILES COc1ccc(cc1OCc1ccc(cc1)[N+](=O)[O-])/C=C\1/SC(=S)N(C1=O)Cc1ccccc1
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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 C25H20N2O5S2 MW 492.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O5S2/c1-31-21-12-9-19(13-22(21)32-16-18-7-10-20(11-8-18)27(29)30)14-23-24(28)26(25(33)34-23)15-17-5-3-2-4-6-17/h2-14H,15-16H2,1H3/b23-14+InChIKey
HXKBOHRDRCCDBF-OEAKJJBVSA-NSynonyms
(5E)3benzyl5((4methoxy3((4nitrophenyl)methoxy)phenyl)methylidene)2sulfanylidene13thiazolidin4one
(5E)3benzyl5(4methoxy3((4nitrobenzyl)oxy)benzylidene)2thioxo13thiazolidin4one
5((4METHOXY3((4NITROPHENYL)METHOXY)PHENYL)METHYLENE)3BENZYL2THIOXO13THIAZOLIDIN4ONE
COC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3)OCC4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1OCc1ccc(cc1)(N+)(=O)(O))C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC25H20N2O5S2c1312112919(1322(21)32161871020(11818)27(29)30)142324(28)26(25(33)3423)15175324617h214H1516H21H3b2314+
MFCD08532519
ZINC000009038864
ZINC09038864
ZINC9038864
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