Vitas-M small molecule compound

ethyl 5-acetyl-2-({(Z)-2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate

Catalog ID
STL339566
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(cc2)C)/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 C23H21N3O3S2 MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O3S2/c1-5-29-23(28)19-14(3)20(15(4)27)31-22(19)25-11-17(10-24)21-26-18(12-30-21)16-8-6-13(2)7-9-16/h6-9,11-12,25H,5H2,1-4H3/b17-11-
InChIKey
QACKJLUTYLKGIR-BOPFTXTBSA-N
Synonyms
842959-17-5
(Z)ethyl5acetyl2((2cyano2(4(ptolyl)thiazol2yl)vinyl)amino)4methylthiophene3carboxylate
842959175
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)C
CCOC(=O)c1c(NC=C(c2scc(n2)c2ccc(cc2)C)C#N)sc(c1C)C(=O)C
ethyl5acetyl2(((Z)2cyano2(4(4methylphenyl)13thiazol2yl)ethenyl)amino)4methylthiophene3carboxylate
InChI=1SC23H21N3O3S2c152923(28)1914(3)20(15(4)27)3122(19)251117(1024)212618(123021)168613(2)7916h69111225H5H214H3b1711
MFCD04012249
ZINC000002403368
ZINC02403368
ZINC2403368

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Available files

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