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

*Links on SpectraBase are not permalinks.
7-(4-Bromophenyl)-5-ethyl-6-(1-piperidinylsulfonyl)4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
SpectraBase Compound ID 5mO5FdYkO7a
InChI InChI=1S/C18H22BrN5O2S/c1-2-15-17(27(25,26)23-10-4-3-5-11-23)16(13-6-8-14(19)9-7-13)24-18(22-15)20-12-21-24/h6-9,12,16H,2-5,10-11H2,1H3,(H,20,21,22)
InChIKey CMWRVTAKAJGMSE-UHFFFAOYSA-N
Mol Weight 452.37 g/mol
Molecular Formula C18H22BrN5O2S
Exact Mass 451.067759 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 I7ezdEEuzKN
Name 7-(4-Bromophenyl)-5-ethyl-6-(1-piperidinylsulfonyl)4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Alternate Name(s) 7-(4-bromophenyl)-5-ethyl-6-(piperidin-1-ylsulfonyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22BrN5O2S
InChI InChI=1S/C18H22BrN5O2S/c1-2-15-17(27(25,26)23-10-4-3-5-11-23)16(13-6-8-14(19)9-7-13)24-18(22-15)20-12-21-24/h6-9,12,16H,2-5,10-11H2,1H3,(H,20,21,22)
InChIKey CMWRVTAKAJGMSE-UHFFFAOYSA-N
Molecular Weight 452.371 g/mol
SMILES N1c2[n](C(C(=C1CC)S(N1CCCCC1)(=O)=O)c1ccc(cc1)Br)ncn2
SPLASH splash10-053r-9322000000-a9cdc834ba82af087eec
Source of Spectrum HC-51-694-4e
Wiley ID 1800790