Vitas-M small molecule compound
methyl 2-({(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4,5-dimethoxybenzoate
Catalog ID
STK536136
SMILES N#C/C(=C\Nc1cc(OC)c(cc1C(=O)OC)OC)/c1scc(n1)c1ccc(cc1)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 C22H18ClN3O4S MW 455.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O4S/c1-28-19-8-16(22(27)30-3)17(9-20(19)29-2)25-11-14(10-24)21-26-18(12-31-21)13-4-6-15(23)7-5-13/h4-9,11-12,25H,1-3H3/b14-11+InChIKey
BKTPCIKMQBVFQM-SDNWHVSQSA-NSynonyms
(E)methyl2((2(4(4chlorophenyl)thiazol2yl)2cyanovinyl)amino)45dimethoxybenzoate
COC1=C(C=C(C(=C1)C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Cl)OC
InChI=1SC22H18ClN3O4Sc12819816(22(27)303)17(920(19)292)251114(1024)212618(123121)134615(23)7513h49111225H13H3b1411+
methyl2(((E)2(4(4chlorophenyl)13thiazol2yl)2cyanoethenyl)amino)45dimethoxybenzoate
MFCD02983057
N#CC(=CNc1cc(OC)c(cc1C(=O)OC)OC)c1scc(n1)c1ccc(cc1)Cl
ZINC000001777028
ZINC01777028
ZINC1777028
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