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

*Links on SpectraBase are not permalinks.
1H-1,2,4-Triazole-3-carboxamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4H-1,2,4-triazol-4-yl)-
SpectraBase Compound ID 4tfgjnncbI5
InChI InChI=1S/C14H12N8OS/c15-5-9-8-3-1-2-4-10(8)24-13(9)19-12(23)11-18-14(21-20-11)22-6-16-17-7-22/h6-7H,1-4H2,(H,19,23)(H,18,20,21)
InChIKey KXUXBBQQIKZNON-UHFFFAOYSA-N
Mol Weight 340.37 g/mol
Molecular Formula C14H12N8OS
Exact Mass 340.085478 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 6pP22wECww8
Name 1H-1,2,4-Triazole-3-carboxamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4H-1,2,4-triazol-4-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N8OS
InChI InChI=1S/C14H12N8OS/c15-5-9-8-3-1-2-4-10(8)24-13(9)19-12(23)11-18-14(21-20-11)22-6-16-17-7-22/h6-7H,1-4H2,(H,19,23)(H,18,20,21)
InChIKey KXUXBBQQIKZNON-UHFFFAOYSA-N
Molecular Weight 340.365 g/mol
SMILES N(C(c1n[nH]c(n1)-[n]1cnnc1)=O)c1sc2CCCCc2c1C#N
SPLASH splash10-0fb9-4910000000-543ea5c43657104f0fc9
Source of Spectrum IY-2-4789-6
Synonyms N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(1,2,4-triazol-4-yl)-1H-1,2,4-triazole-5-carboxamide
Wiley ID 1655879