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

*Links on SpectraBase are not permalinks.
5-(3,4-dimethoxyphenyl)-4-phenyl-2-(1-piperidinylmethyl)-1,2,4-triazole-3-thione
SpectraBase Compound ID KUuU9JHSlpO
InChI InChI=1S/C22H26N4O2S/c1-27-19-12-11-17(15-20(19)28-2)21-23-25(16-24-13-7-4-8-14-24)22(29)26(21)18-9-5-3-6-10-18/h3,5-6,9-12,15H,4,7-8,13-14,16H2,1-2H3
InChIKey NPWBKOZVRBJRIU-UHFFFAOYSA-N
Mol Weight 410.54 g/mol
Molecular Formula C22H26N4O2S
Exact Mass 410.177647 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 ADIyimp2NQF
Name 5-(3,4-dimethoxyphenyl)-4-phenyl-2-(1-piperidinylmethyl)-1,2,4-triazole-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N4O2S
InChI InChI=1S/C22H26N4O2S/c1-27-19-12-11-17(15-20(19)28-2)21-23-25(16-24-13-7-4-8-14-24)22(29)26(21)18-9-5-3-6-10-18/h3,5-6,9-12,15H,4,7-8,13-14,16H2,1-2H3
InChIKey NPWBKOZVRBJRIU-UHFFFAOYSA-N
Molecular Weight 410.536 g/mol
SMILES c1ccc(N2C(N(N=C2c2cc(OC)c(cc2)OC)CN2CCCCC2)=S)cc1
SPLASH splash10-0002-9001000000-244a52c247805608222d
Synonyms 5-(3,4-dimethoxyphenyl)-4-phenyl-2-(1-piperidylmethyl)-1,2,4-triazole-3-thione 5-(3,4-dimethoxyphenyl)-4-phenyl-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione 5-(3,4-dimethoxyphenyl)-4-phenyl-2-(piperidinomethyl)-1,2,4-triazole-3-thione
Wiley ID 1461251