Vitas-M small molecule compound
ethyl 2-({(Z)-2-cyano-2-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK803982
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(cc2)C2CCCCC2)/C#N)sc(c1C)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 C27H29N3O2S2 MW 491.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O2S2/c1-4-32-27(31)24-17(2)18(3)34-26(24)29-15-22(14-28)25-30-23(16-33-25)21-12-10-20(11-13-21)19-8-6-5-7-9-19/h10-13,15-16,19,29H,4-9H2,1-3H3/b22-15-InChIKey
DLVAAQLDXCILSY-JCMHNJIXSA-NSynonyms
585553-69-1(Z)ethyl2((2cyano2(4(4cyclohexylphenyl)thiazol2yl)vinyl)amino)45dimethylthiophene3carboxylate
585553691
CCOC(=O)C1=C(SC(=C1C)C)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)C4CCCCC4
ethyl2(((Z)2cyano2(4(4cyclohexylphenyl)13thiazol2yl)ethenyl)amino)45dimethylthiophene3carboxylate
InChI=1SC27H29N3O2S2c143227(31)2417(2)18(3)3426(24)291522(1428)253023(163325)21121020(111321)198657919h101315161929H49H213H3b2215
MFCD04028191
ZINC000002383458
ZINC02383458
ZINC2383458
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