Vitas-M small molecule compound
ethyl 5-acetyl-2-({(Z)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Catalog ID
STL004080
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cccs2)/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 C20H17N3O3S3 MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O3S3/c1-4-26-20(25)16-11(2)17(12(3)24)29-19(16)22-9-13(8-21)18-23-14(10-28-18)15-6-5-7-27-15/h5-7,9-10,22H,4H2,1-3H3/b13-9-InChIKey
YWWBUEMMOPLTQI-LCYFTJDESA-NSynonyms
(E)ethyl5acetyl2((2cyano2(4(thiophen2yl)thiazol2yl)vinyl)amino)4methylthiophene3carboxylate
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC=C(C#N)C2=NC(=CS2)C3=CC=CS3
CCOC(=O)c1c(NC=C(c2scc(n2)c2cccs2)C#N)sc(c1C)C(=O)C
ethyl5acetyl2(((Z)2cyano2(4(thiophen2yl)13thiazol2yl)ethenyl)amino)4methylthiophene3carboxylate
ETHYL5ACETYL2(((Z)2CYANO2(4THIOPHEN2YL13THIAZOL2YL)ETHENYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC20H17N3O3S3c142620(25)1611(2)17(12(3)24)2919(16)22913(821)182314(102818)156572715h5791022H4H213H3b139
MFCD07207506
ZINC000013757756
ZINC13757756
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