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6-(4-Chloro-6-methoxyquinolin-3-yl)-3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID 5a4CsnRfPOu
InChI InChI=1S/C19H12ClN5OS/c1-26-12-7-8-15-13(9-12)16(20)14(10-21-15)18-24-25-17(22-23-19(25)27-18)11-5-3-2-4-6-11/h2-10H,1H3
InChIKey SFPCFEGPRONKSF-UHFFFAOYSA-N
Mol Weight 393.85 g/mol
Molecular Formula C19H12ClN5OS
Exact Mass 393.045109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AhX4qPvzV9L
Name 6-(4-Chloro-6-methoxyquinolin-3-yl)-3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12ClN5OS
InChI InChI=1S/C19H12ClN5OS/c1-26-12-7-8-15-13(9-12)16(20)14(10-21-15)18-24-25-17(22-23-19(25)27-18)11-5-3-2-4-6-11/h2-10H,1H3
InChIKey SFPCFEGPRONKSF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.20010190816
Molecular Weight 393.852 g/mol
SMILES c1cc(cc2c(c(cnc12)C=1Sc2[n](N1)c(nn2)-c1ccccc1)Cl)OC
SPLASH splash10-00ko-0397000000-2c7e5deb1b733000e99c
Source of Spectrum CJC-19-805-4f
Synonyms 6-(4-Chloro-6-methoxy-3-quinolinyl)-3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-(4-Chloranyl-6-methoxy-quinolin-3-yl)-3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Wiley ID 1773594