Vitas-M small molecule compound
(2Z)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-fluoro-5-nitrophenyl)amino]prop-2-enenitrile
Catalog ID
STK803759
SMILES N#C/C(=C/Nc1cc(ccc1F)[N+](=O)[O-])/c1scc(n1)c1ccc(c(c1)OC)OC
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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 C20H15FN4O4S MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN4O4S/c1-28-18-6-3-12(7-19(18)29-2)17-11-30-20(24-17)13(9-22)10-23-16-8-14(25(26)27)4-5-15(16)21/h3-8,10-11,23H,1-2H3/b13-10-InChIKey
IBBAENDSOXOUHO-RAXLEYEMSA-NSynonyms
(2Z)2(4(34dimethoxyphenyl)13thiazol2yl)3((2fluoro5nitrophenyl)amino)prop2enenitrile
(Z)2(4(34dimethoxyphenyl)13thiazol2yl)3(2fluoro5nitroanilino)prop2enenitrile
(Z)2(4(34dimethoxyphenyl)thiazol2yl)3((2fluoro5nitrophenyl)amino)acrylonitrile
COC1=C(C=C(C=C1)C2=CSC(=N2)C(=CNC3=C(C=CC(=C3)(N+)(=O)(O))F)C#N)OC
InChI=1SC20H15FN4O4Sc128186312(719(18)292)17113020(2417)13(922)102316814(25(26)27)4515(16)21h38101123H12H3b1310
MFCD03668695
N#CC(=CNc1cc(ccc1F)(N+)(=O)(O))c1scc(n1)c1ccc(c(c1)OC)OC
ZINC000013647904
ZINC13647904
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