Vitas-M small molecule compound
ethyl 5-acetyl-2-({(E)-2-cyano-2-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Catalog ID
STL340096
SMILES CCOC(=O)c1c(N/C=C(/c2scc(n2)c2cccc3c2cccc3)\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 C26H21N3O3S2 MW 487.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O3S2/c1-4-32-26(31)22-15(2)23(16(3)30)34-25(22)28-13-18(12-27)24-29-21(14-33-24)20-11-7-9-17-8-5-6-10-19(17)20/h5-11,13-14,28H,4H2,1-3H3/b18-13+InChIKey
VGOIGWXKWCNEFF-QGOAFFKASA-NSynonyms
773865-31-9(E)ethyl5acetyl2((2cyano2(4(naphthalen1yl)thiazol2yl)vinyl)amino)4methylthiophene3carboxylate
773865319
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC=C(C#N)C2=NC(=CS2)C3=CC=CC4=CC=CC=C43
CCOC(=O)c1c(NC=C(c2scc(n2)c2cccc3c2cccc3)C#N)sc(c1C)C(=O)C
ethyl5acetyl2(((E)2cyano2(4(naphthalen1yl)13thiazol2yl)ethenyl)amino)4methylthiophene3carboxylate
ETHYL5ACETYL2(((E)2CYANO2(4NAPHTHALEN1YL13THIAZOL2YL)ETHENYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC26H21N3O3S2c143226(31)2215(2)23(16(3)30)3425(22)281318(1227)242921(143324)201179178561019(17)20h511131428H4H213H3b1813+
MFCD04016679
ZINC000015231481
ZINC15231481
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