Vitas-M small molecule compound
methyl {(5Z)-5-[4-(hexyloxy)-3-methoxybenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetate
Catalog ID
STK969677
SMILES CCCCCCOc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)CC(=O)OC
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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 C20H25NO5S2 MW 423.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO5S2/c1-4-5-6-7-10-26-15-9-8-14(11-16(15)24-2)12-17-19(23)21(20(27)28-17)13-18(22)25-3/h8-9,11-12H,4-7,10,13H2,1-3H3/b17-12-InChIKey
PUWBJHREYORWHL-ATVHPVEESA-NSynonyms
(E)methyl2(5(4(hexyloxy)3methoxybenzylidene)4oxo2thioxothiazolidin3yl)acetate
CCCCCCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)OC)OC
CCCCCCOc1ccc(cc1OC)C=C1SC(=S)N(C1=O)CC(=O)OC
InChI=1SC20H25NO5S2c145671026159814(1116(15)242)121719(23)21(20(27)2817)1318(22)253h891112H471013H213H3b1712
methyl((5Z)5(4(hexyloxy)3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)acetate
METHYL2((5Z)5((4HEXOXY3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETATE
METHYL2(5((4HEXYLOXY3METHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETATE
MFCD02332353
ZINC000004037106
ZINC04037106
ZINC4037106
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.