Vitas-M small molecule compound
(5E)-5-(2-nitrobenzylidene)-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK019015
SMILES C#CCN1C(=O)S/C(=C/c2ccccc2[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 C13H8N2O4S MW 288.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8N2O4S/c1-2-7-14-12(16)11(20-13(14)17)8-9-5-3-4-6-10(9)15(18)19/h1,3-6,8H,7H2/b11-8+InChIKey
PERFCPIABQANAE-DHZHZOJOSA-NSynonyms
(5E)5((2NITROPHENYL)METHYLIDENE)3PROP2YNYL13THIAZOLIDINE24DIONE
(5E)5(2NITROBENZYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
C#CCN1C(=O)C(=CC2=CC=CC=C2(N+)(=O)(O))SC1=O
C#CCN1C(=O)SC(=Cc2ccccc2(N+)(=O)(O))C1=O
InChI=1SC13H8N2O4Sc1271412(16)11(2013(14)17)89534610(9)15(18)19h1368H7H2b118+
MFCD03141166
STK019015
ZINC000012342698
ZINC12342698
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