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

*Links on SpectraBase are not permalinks.
5-[2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID 9plbUA2XDSi
InChI InChI=1S/C13H13N9O2S/c1-21-13(16-19-20-21)25-7-9(23)15-12-10(11(14)24)17-22(18-12)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,14,24)(H,15,18,23)
InChIKey ZTEOWANQFZTQRV-UHFFFAOYSA-N
Mol Weight 359.37 g/mol
Molecular Formula C13H13N9O2S
Exact Mass 359.091292 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 CaQJ33dt0iX
Name 5-[2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N9O2S
InChI InChI=1S/C13H13N9O2S/c1-21-13(16-19-20-21)25-7-9(23)15-12-10(11(14)24)17-22(18-12)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,14,24)(H,15,18,23)
InChIKey ZTEOWANQFZTQRV-UHFFFAOYSA-N
Molecular Weight 359.368 g/mol
SMILES NC(c1n[n](nc1NC(=O)CSc1[n](nnn1)C)-c1ccccc1)=O
SPLASH splash10-0imi-9840000000-e54f324b16cb0f29e271
Synonyms 5-[[2-(1-methyltetrazol-5-yl)sulfanylacetyl]amino]-2-phenyl-triazole-4-carboxamide 5-[[2-[(1-methyl-5-tetrazolyl)thio]-1-oxoethyl]amino]-2-phenyl-4-triazolecarboxamide 5-[[2-[(1-methyltetrazol-5-yl)thio]acetyl]amino]-2-phenyl-triazole-4-carboxamide
Wiley ID 1444499