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7-Methoxy-3-methyl-2-[4-(6-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)phenyl]-1-isoquinolinone
SpectraBase Compound ID 5Op0pdf5SGl
InChI InChI=1S/C26H19N5O2S/c1-16-14-19-10-13-21(33-2)15-22(19)25(32)30(16)20-11-8-17(9-12-20)23-27-28-26-31(23)29-24(34-26)18-6-4-3-5-7-18/h3-15H,1-2H3
InChIKey UJQYEESURZDJJU-UHFFFAOYSA-N
Mol Weight 465.53 g/mol
Molecular Formula C26H19N5O2S
Exact Mass 465.125946 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfLrdPJIPE2
Name 7-Methoxy-3-methyl-2-[4-(6-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)phenyl]-1-isoquinolinone
Alternate Name(s) 7-Methoxy-3-methyl-2-[4-(6-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)phenyl]isocarbostyril 7-Methoxy-3-methyl-2-[4-(6-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)phenyl]isoquinolin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H19N5O2S
InChI InChI=1S/C26H19N5O2S/c1-16-14-19-10-13-21(33-2)15-22(19)25(32)30(16)20-11-8-17(9-12-20)23-27-28-26-31(23)29-24(34-26)18-6-4-3-5-7-18/h3-15H,1-2H3
InChIKey UJQYEESURZDJJU-UHFFFAOYSA-N
Molecular Weight 465.531 g/mol
SMILES C1(N(C(=Cc2ccc(cc12)OC)C)c1ccc(cc1)-c1[n]2c(SC(=N2)c2ccccc2)nn1)=O
SPLASH splash10-014i-0010900000-4360f056bc8e5e29e51b
Source of Spectrum Y1-33-1158-23
Wiley ID 1526381