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4-[[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(2-fluoroanilino)-1,3,5-triazin-2-yl]oxy]benzonitrile
SpectraBase Compound ID 2hN4AsfoAPl
InChI InChI=1S/C25H19FN6O/c26-21-7-3-4-8-22(21)28-23-29-24(32-14-13-18-5-1-2-6-19(18)16-32)31-25(30-23)33-20-11-9-17(15-27)10-12-20/h1-12H,13-14,16H2,(H,28,29,30,31)
InChIKey UONITSIXQVTVQW-UHFFFAOYSA-N
Mol Weight 438.47 g/mol
Molecular Formula C25H19FN6O
Exact Mass 438.160437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YX8dabjEA
Name 4-[[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(2-fluoroanilino)-1,3,5-triazin-2-yl]oxy]benzonitrile
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Formula C25H19FN6O
InChI InChI=1S/C25H19FN6O/c26-21-7-3-4-8-22(21)28-23-29-24(32-14-13-18-5-1-2-6-19(18)16-32)31-25(30-23)33-20-11-9-17(15-27)10-12-20/h1-12H,13-14,16H2,(H,28,29,30,31)
InChIKey UONITSIXQVTVQW-UHFFFAOYSA-N
Molecular Weight 438.466 g/mol
SMILES N(c1nc(N2Cc3c(CC2)cccc3)nc(n1)Oc1ccc(cc1)C#N)c1c(cccc1)F
SPLASH splash10-0019-1922300000-1de283f3a7a5ffbee9a9
Synonyms 4-[[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(2-fluoroanilino)-s-triazin-2-yl]oxy]benzonitrile 4-[[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-[(2-fluorophenyl)amino]-1,3,5-triazin-2-yl]oxy]benzenecarbonitrile
Wiley ID 1445388