Vitas-M small molecule compound
(2Z)-2-cyano-2-[(5E)-5-(2,3-dimethoxybenzylidene)-3-(2-methylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-N-(4-methylphenyl)ethanamide
Catalog ID
STK555872
SMILES COc1cccc(c1OC)/C=c\1/s/c(=C(\C(=O)Nc2ccc(cc2)C)/C#N)/n(c1=O)c1ccccc1C
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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 C29H25N3O4S MW 511.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O4S/c1-18-12-14-21(15-13-18)31-27(33)22(17-30)29-32(23-10-6-5-8-19(23)2)28(34)25(37-29)16-20-9-7-11-24(35-3)26(20)36-4/h5-16H,1-4H3,(H,31,33)/b25-16+,29-22-InChIKey
QSFPWRZLEXSXHM-VSSWJOQFSA-NSynonyms
843632-43-9(2Z)2CYANO2((5E)5((23DIMETHOXYPHENYL)METHYLIDENE)3(2METHYLPHENYL)4OXO13THIAZOLIDIN2YLIDENE)N(4METHYLPHENYL)ACETAMIDE
(2Z)2cyano2((5E)5(23dimethoxybenzylidene)3(2methylphenyl)4oxo13thiazolidin2ylidene)N(4methylphenyl)ethanamide
(Z)2cyano2((E)5(23dimethoxybenzylidene)4oxo3(otolyl)thiazolidin2ylidene)N(ptolyl)acetamide
843632439
CC1=CC=C(C=C1)NC(=O)C(=C2N(C(=O)C(=CC3=C(C(=CC=C3)OC)OC)S2)C4=CC=CC=C4C)C#N
COc1cccc(c1OC)C=c1sc(=C(C(=O)Nc2ccc(cc2)C)C#N)n(c1=O)c1ccccc1C
InChI=1SC29H25N3O4Sc118121421(151318)3127(33)22(1730)2932(231065819(23)2)28(34)25(3729)1620971124(353)26(20)364h516H14H3(H3133)b2516+2922
MFCD04014190
ZINC000009457091
ZINC09457091
ZINC9457091
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.