Vitas-M small molecule compound
ethyl 5-acetyl-2-({(Z)-2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Catalog ID
STL339299
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(c(c2)Cl)Cl)/C#N)sc(c1C)C(=O)C
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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 C22H17Cl2N3O3S2 MW 506.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17Cl2N3O3S2/c1-4-30-22(29)18-11(2)19(12(3)28)32-21(18)26-9-14(8-25)20-27-17(10-31-20)13-5-6-15(23)16(24)7-13/h5-7,9-10,26H,4H2,1-3H3/b14-9-InChIKey
JMPGUOGUEZFIIN-ZROIWOOFSA-NSynonyms
840515-57-3(Z)ethyl5acetyl2((2cyano2(4(34dichlorophenyl)thiazol2yl)vinyl)amino)4methylthiophene3carboxylate
840515573
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC=C(C#N)C2=NC(=CS2)C3=CC(=C(C=C3)Cl)Cl
CCOC(=O)c1c(NC=C(c2scc(n2)c2ccc(c(c2)Cl)Cl)C#N)sc(c1C)C(=O)C
ethyl5acetyl2(((Z)2cyano2(4(34dichlorophenyl)13thiazol2yl)ethenyl)amino)4methylthiophene3carboxylate
InChI=1SC22H17Cl2N3O3S2c143022(29)1811(2)19(12(3)28)3221(18)26914(825)202717(103120)135615(23)16(24)713h5791026H4H213H3b149
MFCD04010334
ZINC000002351889
ZINC02351889
ZINC2351889
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