For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-(2-Bromobenzylthio)-5-((5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylthio)methyl)-1,3,4-thiadiazole
SpectraBase Compound ID Hgp34NQIGbZ
InChI InChI=1S/C17H15BrN6S3/c1-10-7-11(2)24-15(19-10)20-16(23-24)25-9-14-21-22-17(27-14)26-8-12-5-3-4-6-13(12)18/h3-7H,8-9H2,1-2H3
InChIKey NWGSMKDCXMBNRW-UHFFFAOYSA-N
Mol Weight 479.43 g/mol
Molecular Formula C17H15BrN6S3
Exact Mass 477.970371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5AZZnZeu0vS
Name 2-(2-Bromobenzylthio)-5-((5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylthio)methyl)-1,3,4-thiadiazole
Alternate Name(s) 2-((2-bromobenzyl)thio)-5-(((5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio)methyl)-1,3,4-thiadiazole 2-[(2-bromophenyl)methylthio]-5-[[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio]methyl]-1,3,4-thiadiazole 2-[(2-bromophenyl)methylsulfanyl]-5-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]-1,3,4-thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15BrN6S3
InChI InChI=1S/C17H15BrN6S3/c1-10-7-11(2)24-15(19-10)20-16(23-24)25-9-14-21-22-17(27-14)26-8-12-5-3-4-6-13(12)18/h3-7H,8-9H2,1-2H3
InChIKey NWGSMKDCXMBNRW-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.ejmech.2013.04.014
Molecular Weight 479.433 g/mol
SMILES C=1C(C)=Nc2nc(n[n]2C1C)SCc1nnc(s1)SCc1c(cccc1)Br
SPLASH splash10-05n0-4910000000-45802e91ef89d883c9cb
Source of Spectrum EMC-64-58-16
Wiley ID 1755172