Vitas-M small molecule compound
ethyl 2-({(Z)-2-cyano-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK552173
SMILES CCOc1ccc(cc1)c1csc(n1)/C(=C\Nc1sc2c(c1C(=O)OCC)CCCC2)/C#N
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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 C25H25N3O3S2 MW 479.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3S2/c1-3-30-18-11-9-16(10-12-18)20-15-32-23(28-20)17(13-26)14-27-24-22(25(29)31-4-2)19-7-5-6-8-21(19)33-24/h9-12,14-15,27H,3-8H2,1-2H3/b17-14-InChIKey
TVHGVFYWXBXENL-VKAVYKQESA-NSynonyms
799768-64-2(Z)ethyl2((2cyano2(4(4ethoxyphenyl)thiazol2yl)vinyl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
799768642
CCOC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=C(C4=C(S3)CCCC4)C(=O)OCC)C#N
CCOc1ccc(cc1)c1csc(n1)C(=CNc1sc2c(c1C(=O)OCC)CCCC2)C#N
ethyl2(((Z)2cyano2(4(4ethoxyphenyl)13thiazol2yl)ethenyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC25H25N3O3S2c13301811916(101218)20153223(2820)17(1326)14272422(25(29)3142)19756821(19)3324h912141527H38H212H3b1714
MFCD03670817
ZINC000009075433
ZINC09075433
ZINC9075433
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