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3H-Benzo[e][1,2,4]triazepine, 2-phenyl-5-p-tolylsulfanyl-
SpectraBase Compound ID Gh3oEf3zuX1
InChI InChI=1S/C21H17N3S/c1-15-11-13-17(14-12-15)25-21-18-9-5-6-10-19(18)22-20(23-24-21)16-7-3-2-4-8-16/h2-14H,1H3,(H,22,23)
InChIKey FHYGLUHFTCZPOW-UHFFFAOYSA-N
Mol Weight 343.45 g/mol
Molecular Formula C21H17N3S
Exact Mass 343.114319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfDgIzq4vzG
Name 3H-Benzo[e][1,2,4]triazepine, 2-phenyl-5-p-tolylsulfanyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17N3S
InChI InChI=1S/C21H17N3S/c1-15-11-13-17(14-12-15)25-21-18-9-5-6-10-19(18)22-20(23-24-21)16-7-3-2-4-8-16/h2-14H,1H3,(H,22,23)
InChIKey FHYGLUHFTCZPOW-UHFFFAOYSA-N
Molecular Weight 343.448 g/mol
SMILES N1N=C(c2c(N=C1c1ccccc1)cccc2)Sc1ccc(cc1)C
SPLASH splash10-002f-9322000000-d6bd42668c32af35e622
Synonyms 2-Phenyl-5-(p-tolylsulfanyl)-3H-1,3,4-benzotriazepine 2-Phenyl-5-(p-tolylthio)-3H-1,3,4-benzotriazepine 5-(4-Methylphenyl)sulfanyl-2-phenyl-3H-1,3,4-benzotriazepine 5-[(4-methylphenyl)thio]-2-phenyl-3H-1,3,4-benzotriazepine
Wiley ID 1440577