Vitas-M small molecule compound
(5E)-5-(2-chloro-4,5-dimethoxybenzylidene)-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK027241
SMILES COc1cc(/C=C\2/SC(=O)N(C2=O)CC#C)c(cc1OC)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 C15H12ClNO4S MW 337.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12ClNO4S/c1-4-5-17-14(18)13(22-15(17)19)7-9-6-11(20-2)12(21-3)8-10(9)16/h1,6-8H,5H2,2-3H3/b13-7+InChIKey
ISWPCVWAMMKCBR-NTUHNPAUSA-NSynonyms
(5E)5((2CHLORO45DIMETHOXYPHENYL)METHYLIDENE)3PROP2YNYL13THIAZOLIDINE24DIONE
(5E)5(2CHLORO45DIMETHOXYBENZYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
COC1=C(C=C(C(=C1)C=C2C(=O)N(C(=O)S2)CC#C)Cl)OC
COc1cc(C=C2SC(=O)N(C2=O)CC#C)c(cc1OC)Cl
InChI=1SC15H12ClNO4Sc1451714(18)13(2215(17)19)79611(202)12(213)810(9)16h168H5H223H3b137+
MFCD03142069
STK027241
ZINC000001164720
ZINC01164720
ZINC1164720
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