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3-(2,1,3-benzothiadiazol-5-ylmethylsulfanyl)-4-phenyl-1H-1,2,4-triazol-5-one
SpectraBase Compound ID 57LFREp5Uuo
InChI InChI=1S/C15H11N5OS2/c21-14-16-17-15(20(14)11-4-2-1-3-5-11)22-9-10-6-7-12-13(8-10)19-23-18-12/h1-8H,9H2,(H,16,21)
InChIKey XQAVYGAKAMLGQL-UHFFFAOYSA-N
Mol Weight 341.41 g/mol
Molecular Formula C15H11N5OS2
Exact Mass 341.040502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGnPOzebGOG
Name 3-(2,1,3-benzothiadiazol-5-ylmethylsulfanyl)-4-phenyl-1H-1,2,4-triazol-5-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11N5OS2
InChI InChI=1S/C15H11N5OS2/c21-14-16-17-15(20(14)11-4-2-1-3-5-11)22-9-10-6-7-12-13(8-10)19-23-18-12/h1-8H,9H2,(H,16,21)
InChIKey XQAVYGAKAMLGQL-UHFFFAOYSA-N
Molecular Weight 341.407 g/mol
SMILES N1C(N(C(=N1)SCc1cc2c(cc1)nsn2)c1ccccc1)=O
SPLASH splash10-0002-4900000000-8dbf74860ac1154b2f50
Synonyms 3-(2,1,3-benzothiadiazol-5-ylmethylthio)-4-phenyl-1H-1,2,4-triazol-5-one 4-Phenyl-3-(piazthiol-5-ylmethylthio)-1H-1,2,4-triazol-5-one 5-[(2,1,3-benzothiadiazol-5-ylmethyl)sulfanyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Wiley ID 1450279