Vitas-M small molecule compound
ethyl 2-({(Z)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK552052
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(cc2)Cl)/C#N)sc2c1CCCC2
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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 C23H20ClN3O2S2 MW 470.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN3O2S2/c1-2-29-23(28)20-17-5-3-4-6-19(17)31-22(20)26-12-15(11-25)21-27-18(13-30-21)14-7-9-16(24)10-8-14/h7-10,12-13,26H,2-6H2,1H3/b15-12-InChIKey
WUESHSCOJWYJNK-QINSGFPZSA-NSynonyms
799776-78-6(Z)ethyl2((2(4(4chlorophenyl)thiazol2yl)2cyanovinyl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
799776786
CCOC(=O)C1=C(SC2=C1CCCC2)NC=C(C#N)C3=NC(=CS3)C4=CC=C(C=C4)Cl
CCOC(=O)c1c(NC=C(c2scc(n2)c2ccc(cc2)Cl)C#N)sc2c1CCCC2
ethyl2(((Z)2(4(4chlorophenyl)13thiazol2yl)2cyanoethenyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC23H20ClN3O2S2c122923(28)2017534619(17)3122(20)261215(1125)212718(133021)147916(24)10814h710121326H26H21H3b1512
MFCD03672971
ZINC000002207596
ZINC02207596
ZINC2207596
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