Vitas-M small molecule compound
(5E)-3-(3,4-dichlorobenzyl)-5-{4-[(2-hydroxyethyl)sulfanyl]-3-nitrobenzylidene}-1,3-thiazolidine-2,4-dione
Catalog ID
STL380904
SMILES OCCSc1ccc(cc1[N+](=O)[O-])/C=C\1/SC(=O)N(C1=O)Cc1ccc(c(c1)Cl)Cl
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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 C19H14Cl2N2O5S2 MW 485.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14Cl2N2O5S2/c20-13-3-1-12(7-14(13)21)10-22-18(25)17(30-19(22)26)9-11-2-4-16(29-6-5-24)15(8-11)23(27)28/h1-4,7-9,24H,5-6,10H2/b17-9+InChIKey
HMDGJEVVONPLSH-RQZCQDPDSA-NSynonyms
(5E)3((34dichlorophenyl)methyl)5((4(2hydroxyethylsulfanyl)3nitrophenyl)methylidene)13thiazolidine24dione
(5E)3(34dichlorobenzyl)5(4((2hydroxyethyl)sulfanyl)3nitrobenzylidene)13thiazolidine24dione
C1=CC(=C(C=C1CN2C(=O)C(=CC3=CC(=C(C=C3)SCCO)(N+)(=O)(O))SC2=O)Cl)Cl
InChI=1SC19H14Cl2N2O5S2c20133112(714(13)21)102218(25)17(3019(22)26)9112416(296524)15(811)23(27)28h147924H5610H2b179+
MFCD28951175
OCCSc1ccc(cc1(N+)(=O)(O))C=C1SC(=O)N(C1=O)Cc1ccc(c(c1)Cl)Cl
ZINC000033681558
ZINC33681558
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