Vitas-M small molecule compound

methyl 2-({(E)-2-cyano-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate

Catalog ID
STK537250
SMILES N#C/C(=C\Nc1ccccc1C(=O)OC)/c1scc(n1)c1ccc(cc1)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 C22H19N3O2S MW 389.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O2S/c1-3-15-8-10-16(11-9-15)20-14-28-21(25-20)17(12-23)13-24-19-7-5-4-6-18(19)22(26)27-2/h4-11,13-14,24H,3H2,1-2H3/b17-13+
InChIKey
HFVLFTCDWPAJOC-GHRIWEEISA-N
Synonyms

(E)methyl2((2cyano2(4(4ethylphenyl)thiazol2yl)vinyl)amino)benzoate
CCC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=CC=C3C(=O)OC)C#N
InChI=1SC22H19N3O2Sc131581016(11915)20142821(2520)17(1223)132419754618(19)22(26)272h411131424H3H212H3b1713+
methyl2(((E)2cyano2(4(4ethylphenyl)13thiazol2yl)ethenyl)amino)benzoate
MFCD02983955
N#CC(=CNc1ccccc1C(=O)OC)c1scc(n1)c1ccc(cc1)CC
ZINC000001241394
ZINC01241394
ZINC1241394

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.