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7-Methoxy-3-methyl-2-[4-(6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl)phenyl]-1-isoquinolinone
SpectraBase Compound ID 9wZHOHVTQsU
InChI InChI=1S/C27H21N5O2S/c1-17-14-20-10-13-22(34-2)15-23(20)26(33)31(17)21-11-8-19(9-12-21)25-28-29-27-32(25)30-24(16-35-27)18-6-4-3-5-7-18/h3-15H,16H2,1-2H3
InChIKey SFIHWDCJYPDUEG-UHFFFAOYSA-N
Mol Weight 479.56 g/mol
Molecular Formula C27H21N5O2S
Exact Mass 479.141596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMUsQMOtPDH
Name 7-Methoxy-3-methyl-2-[4-(6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl)phenyl]-1-isoquinolinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H21N5O2S
InChI InChI=1S/C27H21N5O2S/c1-17-14-20-10-13-22(34-2)15-23(20)26(33)31(17)21-11-8-19(9-12-21)25-28-29-27-32(25)30-24(16-35-27)18-6-4-3-5-7-18/h3-15H,16H2,1-2H3
InChIKey SFIHWDCJYPDUEG-UHFFFAOYSA-N
Molecular Weight 479.558 g/mol
SMILES C1(=N[n]2c(SC1)nnc2-c1ccc(N2C(c3cc(OC)ccc3C=C2C)=O)cc1)c1ccccc1
SPLASH splash10-004i-0050900000-6a29651f05b49dac9f00
Source of Spectrum Y1-33-1157-24
Synonyms 7-Methoxy-3-methyl-2-[4-(6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl)phenyl]isocarbostyril 7-Methoxy-3-methyl-2-[4-(6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl)phenyl]isoquinolin-1-one
Wiley ID 1526380