Vitas-M small molecule compound
methyl 2-({(E)-2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Catalog ID
STK535837
SMILES N#C/C(=C\Nc1ccccc1C(=O)OC)/c1scc(n1)c1ccc(c(c1)Cl)Cl
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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 C20H13Cl2N3O2S MW 430.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13Cl2N3O2S/c1-27-20(26)14-4-2-3-5-17(14)24-10-13(9-23)19-25-18(11-28-19)12-6-7-15(21)16(22)8-12/h2-8,10-11,24H,1H3/b13-10+InChIKey
ABDQPUHAPAHRHB-JLHYYAGUSA-NSynonyms
(E)methyl2((2cyano2(4(34dichlorophenyl)thiazol2yl)vinyl)amino)benzoate
COC(=O)C1=CC=CC=C1NC=C(C#N)C2=NC(=CS2)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC20H13Cl2N3O2Sc12720(26)14423517(14)241013(923)192518(112819)126715(21)16(22)812h28101124H1H3b1310+
methyl2(((E)2cyano2(4(34dichlorophenyl)13thiazol2yl)ethenyl)amino)benzoate
MFCD02983476
N#CC(=CNc1ccccc1C(=O)OC)c1scc(n1)c1ccc(c(c1)Cl)Cl
ZINC000001244880
ZINC01244880
ZINC1244880
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