Vitas-M small molecule compound
methyl 2-({(E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Catalog ID
STK537182
SMILES N#C/C(=C\Nc1ccccc1C(=O)OC)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]
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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 C20H14N4O4S MW 406.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O4S/c1-28-20(25)16-7-2-3-8-17(16)22-11-14(10-21)19-23-18(12-29-19)13-5-4-6-15(9-13)24(26)27/h2-9,11-12,22H,1H3/b14-11+InChIKey
HUBYSFBYHUKRMJ-SDNWHVSQSA-NSynonyms
(E)methyl2((2cyano2(4(3nitrophenyl)thiazol2yl)vinyl)amino)benzoate
COC(=O)C1=CC=CC=C1NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC20H14N4O4Sc12820(25)16723817(16)221114(1021)192318(122919)1354615(913)24(26)27h29111222H1H3b1411+
methyl2(((E)2cyano2(4(3nitrophenyl)13thiazol2yl)ethenyl)amino)benzoate
MFCD02982849
N#CC(=CNc1ccccc1C(=O)OC)c1scc(n1)c1cccc(c1)(N+)(=O)(O)
ZINC000004812706
ZINC04812706
ZINC4812706
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