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6-(4-Chloro-6-methylquinolin-3-yl)-3-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID GMmYMWpashs
InChI InChI=1S/C19H11Cl2N5S/c1-10-2-7-15-13(8-10)16(21)14(9-22-15)18-25-26-17(23-24-19(26)27-18)11-3-5-12(20)6-4-11/h2-9H,1H3
InChIKey ITYTUNUGGJQCSL-UHFFFAOYSA-N
Mol Weight 412.3 g/mol
Molecular Formula C19H11Cl2N5S
Exact Mass 411.011222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Lyiayq3AnS
Name 6-(4-Chloro-6-methylquinolin-3-yl)-3-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H11Cl2N5S
InChI InChI=1S/C19H11Cl2N5S/c1-10-2-7-15-13(8-10)16(21)14(9-22-15)18-25-26-17(23-24-19(26)27-18)11-3-5-12(20)6-4-11/h2-9H,1H3
InChIKey ITYTUNUGGJQCSL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.20010190816
Molecular Weight 412.298 g/mol
SMILES c1cc(cc2c(c(cnc12)C=1Sc2[n](N1)c(nn2)-c1ccc(cc1)Cl)Cl)C
SPLASH splash10-03di-0230900000-9c8ffadaacda6b0c87ce
Source of Spectrum CJC-19-805-4k
Synonyms 6-(4-Chloro-6-methyl-3-quinolinyl)-3-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-(4-Chloranyl-6-methyl-quinolin-3-yl)-3-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Wiley ID 1773596