Vitas-M small molecule compound
2-(diethylamino)ethyl 4-({(Z)-2-cyano-2-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Catalog ID
STK552927
SMILES CCN(CCOC(=O)c1ccc(cc1)N/C=C(\c1scc(n1)c1ccc(cc1)C1CCCCC1)/C#N)CC
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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 C31H36N4O2S MW 528.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N4O2S/c1-3-35(4-2)18-19-37-31(36)26-14-16-28(17-15-26)33-21-27(20-32)30-34-29(22-38-30)25-12-10-24(11-13-25)23-8-6-5-7-9-23/h10-17,21-23,33H,3-9,18-19H2,1-2H3/b27-21-InChIKey
VHZKZDOWVPFZQZ-MEFGMAGPSA-NSynonyms
799770-83-5(Z)2(diethylamino)ethyl4((2cyano2(4(4cyclohexylphenyl)thiazol2yl)vinyl)amino)benzoate
2(diethylamino)ethyl4(((Z)2cyano2(4(4cyclohexylphenyl)13thiazol2yl)ethenyl)amino)benzoate
799770835
CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)C4CCCCC4
CCN(CCOC(=O)c1ccc(cc1)NC=C(c1scc(n1)c1ccc(cc1)C1CCCCC1)C#N)CC
InChI=1SC31H36N4O2Sc1335(42)18193731(36)26141628(171526)332127(2032)303429(223830)25121024(111325)238657923h1017212333H391819H212H3b2721
MFCD03671607
ZINC000009009867
ZINC9009867
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