Vitas-M small molecule compound
(5E)-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK152536
SMILES C#CCN1C(=O)S/C(=C/c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/C1=O
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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 C20H14N2O5S MW 394.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O5S/c1-2-11-21-19(23)18(28-20(21)24)12-15-5-3-4-6-17(15)27-13-14-7-9-16(10-8-14)22(25)26/h1,3-10,12H,11,13H2/b18-12+InChIKey
BBODWEIEZUKHSY-LDADJPATSA-NSynonyms
(5E)5((2((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)3PROP2YNYL13THIAZOLIDINE24DIONE
(5E)5(2((4NITROBENZYL)OXY)BENZYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
C#CCN1C(=O)C(=CC2=CC=CC=C2OCC3=CC=C(C=C3)(N+)(=O)(O))SC1=O
C#CCN1C(=O)SC(=Cc2ccccc2OCc2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC20H14N2O5Sc12112119(23)18(2820(21)24)1215534617(15)2713147916(10814)22(25)26h131012H1113H2b1812+
MFCD03705285
ZINC000004694810
ZINC04694810
ZINC4694810
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