Vitas-M small molecule compound
(5Z)-3-(1,3-benzodioxol-5-ylmethyl)-5-[4-(benzyloxy)-3-methoxybenzylidene]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK825896
SMILES COc1cc(ccc1OCc1ccccc1)/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2
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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 C26H21NO5S2 MW 491.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21NO5S2/c1-29-22-11-18(7-9-20(22)30-15-17-5-3-2-4-6-17)13-24-25(28)27(26(33)34-24)14-19-8-10-21-23(12-19)32-16-31-21/h2-13H,14-16H2,1H3/b24-13-InChIKey
MEZIEXIOMOFMIH-CFRMEGHHSA-NSynonyms
(5Z)3(13BENZODIOXOL5YLMETHYL)5((3METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(13benzodioxol5ylmethyl)5(4(benzyloxy)3methoxybenzylidene)2thioxo13thiazolidin4one
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC4=C(C=C3)OCO4)OCC5=CC=CC=C5
COc1cc(ccc1OCc1ccccc1)C=C1SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2
InChI=1SC26H21NO5S2c129221118(7920(22)3015175324617)132425(28)27(26(33)3424)14198102123(1219)32163121h213H1416H21H3b2413
MFCD03213125
ZINC000015015190
ZINC15015190
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