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(E)-2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-3-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]prop-2-enenitrile

View entire compound with spectra: 1 MS (GC)

(E)-2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-3-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]prop-2-enenitrile
SpectraBase Compound ID Dc72wcOFJBp
InChI InChI=1S/C22H10BrClF3N3O2S/c23-14-2-4-19-11(5-14)6-15(21(31)32-19)18-10-33-20(30-18)12(8-28)9-29-17-7-13(22(25,26)27)1-3-16(17)24/h1-7,9-10,29H/b12-9+
InChIKey AXQUPXRIVQLVPX-FMIVXFBMSA-N
Mol Weight 552.75 g/mol
Molecular Formula C22H10BrClF3N3O2S
Exact Mass 550.931773 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Ozfh2HtnRk
Name (E)-2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-3-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]prop-2-enenitrile
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Formula C22H10BrClF3N3O2S
InChI InChI=1S/C22H10BrClF3N3O2S/c23-14-2-4-19-11(5-14)6-15(21(31)32-19)18-10-33-20(30-18)12(8-28)9-29-17-7-13(22(25,26)27)1-3-16(17)24/h1-7,9-10,29H/b12-9+
InChIKey AXQUPXRIVQLVPX-FMIVXFBMSA-N
Molecular Weight 552.753 g/mol
SMILES N(c1cc(C(F)(F)F)ccc1Cl)\C=C\(c1nc(C=2C(Oc3c(C2)cc(cc3)Br)=O)cs1)C#N
SPLASH splash10-0udi-2940050000-95bfd022158a9644f317
Synonyms (E)-2-[4-(6-bromo-2-keto-chromen-3-yl)thiazol-2-yl]-3-[2-chloro-5-(trifluoromethyl)anilino]acrylonitrile (E)-2-[4-(6-bromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-3-[2-chloro-5-(trifluoromethyl)anilino]-2-propenenitrile (E)-2-[4-(6-bromo-2-oxo-chromen-3-yl)thiazol-2-yl]-3-[2-chloro-5-(trifluoromethyl)anilino]prop-2-enenitrile (E)-2-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-3-[2-chloro-5-(trifluoromethyl)anilino]prop-2-enenitrile
Wiley ID 1455173