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Thieno[2,3-b]pyridine-2-carboxamide, 3-amino-6-(1,3-benzodioxol-5-yl)-N-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID LgysYna2Hno
InChI InChI=1S/C22H14F3N3O3S/c23-22(24,25)12-2-1-3-13(9-12)27-20(29)19-18(26)14-5-6-15(28-21(14)32-19)11-4-7-16-17(8-11)31-10-30-16/h1-9H,10,26H2,(H,27,29)
InChIKey FHDSUDSSXMQQOR-UHFFFAOYSA-N
Mol Weight 457.43 g/mol
Molecular Formula C22H14F3N3O3S
Exact Mass 457.070797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3iDi2ormHzt
Name Thieno[2,3-b]pyridine-2-carboxamide, 3-amino-6-(1,3-benzodioxol-5-yl)-N-[3-(trifluoromethyl)phenyl]-
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Formula C22H14F3N3O3S
InChI InChI=1S/C22H14F3N3O3S/c23-22(24,25)12-2-1-3-13(9-12)27-20(29)19-18(26)14-5-6-15(28-21(14)32-19)11-4-7-16-17(8-11)31-10-30-16/h1-9H,10,26H2,(H,27,29)
InChIKey FHDSUDSSXMQQOR-UHFFFAOYSA-N
Molecular Weight 457.427 g/mol
SMILES Nc1c2ccc(nc2sc1C(Nc1cc(C(F)(F)F)ccc1)=O)-c1cc2c(OCO2)cc1
SPLASH splash10-0002-1390100000-e65941d6dcd71c02576f
Source of Spectrum IY-1-4678-2
Synonyms 3-Amino-6-(1,3-benzodioxol-5-yl)-N-[3-(trifluoromethyl)phenyl]-2-thieno[2,3-b]pyridinecarboxamide 3-Azanyl-6-(1,3-benzodioxol-5-yl)-N-[3-(trifluoromethyl)phenyl]thieno[2,3-b]pyridine-2-carboxamide
Wiley ID 1654765