Vitas-M small molecule compound
(2E)-3-{[2-(2-chloro-1,1,2-trifluoroethoxy)phenyl]amino}-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK537176
SMILES N#C/C(=C\Nc1ccccc1OC(C(Cl)F)(F)F)/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 C20H12ClF3N4O3S MW 480.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12ClF3N4O3S/c21-19(22)20(23,24)31-17-7-2-1-6-15(17)26-10-13(9-25)18-27-16(11-32-18)12-4-3-5-14(8-12)28(29)30/h1-8,10-11,19,26H/b13-10+InChIKey
LLTPCLKVQJZCOY-JLHYYAGUSA-NSynonyms
(2E)3((2(2chloro112trifluoroethoxy)phenyl)amino)2(4(3nitrophenyl)13thiazol2yl)prop2enenitrile
(E)3((2(2chloro112trifluoroethoxy)phenyl)amino)2(4(3nitrophenyl)thiazol2yl)acrylonitrile
(E)3(2(2CHLORO112TRIFLUOROETHOXY)ANILINO)2(4(3NITROPHENYL)13THIAZOL2YL)PROP2ENENITRILE
C1=CC=C(C(=C1)NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)(N+)(=O)(O))OC(C(F)Cl)(F)F
InChI=1SC20H12ClF3N4O3Sc2119(22)20(2324)3117721615(17)261013(925)182716(113218)1243514(812)28(29)30h1810111926Hb1310+
MFCD02983033
N#CC(=CNc1ccccc1OC(C(Cl)F)(F)F)c1scc(n1)c1cccc(c1)(N+)(=O)(O)
ZINC000009044960
ZINC000009044963
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