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N-[2-[6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]phenyl]-4-methoxy-benzamide
SpectraBase Compound ID LQ57CqmKUWZ
InChI InChI=1S/C24H18ClN5O2S/c1-32-18-12-8-16(9-13-18)23(31)26-20-5-3-2-4-19(20)22-27-28-24-30(22)29-21(14-33-24)15-6-10-17(25)11-7-15/h2-13H,14H2,1H3,(H,26,31)
InChIKey LJWVMTUHEAUJTN-UHFFFAOYSA-N
Mol Weight 475.95 g/mol
Molecular Formula C24H18ClN5O2S
Exact Mass 475.086974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4JTeAEZhHr0
Name N-[2-[6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]phenyl]-4-methoxy-benzamide
CAS Registry Number 106346-33-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18ClN5O2S
InChI InChI=1S/C24H18ClN5O2S/c1-32-18-12-8-16(9-13-18)23(31)26-20-5-3-2-4-19(20)22-27-28-24-30(22)29-21(14-33-24)15-6-10-17(25)11-7-15/h2-13H,14H2,1H3,(H,26,31)
InChIKey LJWVMTUHEAUJTN-UHFFFAOYSA-N
Molecular Weight 475.954 g/mol
SMILES N(C(c1ccc(cc1)OC)=O)c1c(-c2[n]3N=C(c4ccc(cc4)Cl)CSc3nn2)cccc1
SPLASH splash10-004l-0000900000-86677dee10d56dcdb695
Source of Spectrum Y-23-47-6
Wiley ID 1394092