Vitas-M small molecule compound
4-ethyl 2-prop-2-en-1-yl 5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK803945
SMILES C=CCOC(=O)c1sc(c(c1C)C(=O)OCC)N/C=C(\c1scc(n1)c1ccc2c(c1)OCO2)/C#N
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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 C25H21N3O6S2 MW 523.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O6S2/c1-4-8-32-25(30)21-14(3)20(24(29)31-5-2)23(36-21)27-11-16(10-26)22-28-17(12-35-22)15-6-7-18-19(9-15)34-13-33-18/h4,6-7,9,11-12,27H,1,5,8,13H2,2-3H3/b16-11-InChIKey
LJLMUWPRQRFUEJ-WJDWOHSUSA-NSynonyms
585552-63-2(Z)2allyl4ethyl5((2(4(benzo(d)(13)dioxol5yl)thiazol2yl)2cyanovinyl)amino)3methylthiophene24dicarboxylate
4ethyl2prop2en1yl5(((Z)2(4(13benzodioxol5yl)13thiazol2yl)2cyanoethenyl)amino)3methylthiophene24dicarboxylate
4OETHYL2OPROP2ENYL5(((Z)2(4(13BENZODIOXOL5YL)13THIAZOL2YL)2CYANOETHENYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
585552632
C=CCOC(=O)c1sc(c(c1C)C(=O)OCC)NC=C(c1scc(n1)c1ccc2c(c1)OCO2)C#N
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC=C)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4
InChI=1SC25H21N3O6S2c1483225(30)2114(3)20(24(29)3152)23(3621)271116(1026)222817(123522)15671819(915)34133318h4679111227H15813H223H3b1611
MFCD04028139
ZINC000002383287
ZINC2383287
Check stock
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Check stock on Vitas-MAvailable files
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