Vitas-M small molecule compound
(2E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-{[2-(difluoromethoxy)phenyl]amino}prop-2-enenitrile
Catalog ID
STK538005
SMILES N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1cc2cc(Br)ccc2oc1=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 C22H12BrF2N3O3S MW 516.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12BrF2N3O3S/c23-14-5-6-18-12(7-14)8-15(21(29)30-18)17-11-32-20(28-17)13(9-26)10-27-16-3-1-2-4-19(16)31-22(24)25/h1-8,10-11,22,27H/b13-10+InChIKey
OKAAKFMYTPZQGH-JLHYYAGUSA-NSynonyms
(2E)2(4(6bromo2oxo2Hchromen3yl)13thiazol2yl)3((2(difluoromethoxy)phenyl)amino)prop2enenitrile
(E)2(4(6bromo2oxo2Hchromen3yl)thiazol2yl)3((2(difluoromethoxy)phenyl)amino)acrylonitrile
(E)2(4(6BROMO2OXOCHROMEN3YL)13THIAZOL2YL)3(2(DIFLUOROMETHOXY)ANILINO)PROP2ENENITRILE
C1=CC=C(C(=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O)OC(F)F
InChI=1SC22H12BrF2N3O3Sc2314561812(714)815(21(29)3018)17113220(2817)13(926)102716312419(16)3122(24)25h1810112227Hb1310+
MFCD02982696
N#CC(=CNc1ccccc1OC(F)F)c1scc(n1)c1cc2cc(Br)ccc2oc1=O
ZINC000100747673
ZINC100747673
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