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5-Chloro-1-(1-methyl-3-phenyl-propyl)-1H-benzoimidazole-2-thiol
SpectraBase Compound ID EMjmQY2Dr6C
InChI InChI=1S/C17H17ClN2S/c1-12(7-8-13-5-3-2-4-6-13)20-16-10-9-14(18)11-15(16)19-17(20)21/h2-6,9-12H,7-8H2,1H3,(H,19,21)
InChIKey RNDZJBDDKDIPLI-UHFFFAOYSA-N
Mol Weight 316.85 g/mol
Molecular Formula C17H17ClN2S
Exact Mass 316.080097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AusgQV60aNG
Name 5-Chloro-1-(1-methyl-3-phenyl-propyl)-1H-benzoimidazole-2-thiol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClN2S
InChI InChI=1S/C17H17ClN2S/c1-12(7-8-13-5-3-2-4-6-13)20-16-10-9-14(18)11-15(16)19-17(20)21/h2-6,9-12H,7-8H2,1H3,(H,19,21)
InChIKey RNDZJBDDKDIPLI-UHFFFAOYSA-N
Molecular Weight 316.850 g/mol
SMILES Sc1nc2cc(Cl)ccc2[n]1C(CCc1ccccc1)C
SPLASH splash10-001i-4960000000-b8fca205e07b699614a5
Synonyms 5-Chloro-1-(1-methyl-3-phenylpropyl)-1H-benzimidazole-2-thiol 6-Chloranyl-3-(4-phenylbutan-2-yl)-1H-benzimidazole-2-thione 6-Chloro-3-(1-methyl-3-phenyl-propyl)-1H-benzimidazole-2-thione 6-Chloro-3-(4-phenylbutan-2-yl)-1H-benzimidazole-2-thione
Wiley ID 1463603