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2-({[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1-(2-phenylethyl)-1H-benzimidazole
SpectraBase Compound ID LZ95ZiT0fd6
InChI InChI=1S/C30H24ClN5S/c31-25-16-8-7-15-24(25)29-33-34-30(36(29)23-13-5-2-6-14-23)37-21-28-32-26-17-9-10-18-27(26)35(28)20-19-22-11-3-1-4-12-22/h1-18H,19-21H2
InChIKey DGPSDJQDSAWXEO-UHFFFAOYSA-N
Mol Weight 522.07 g/mol
Molecular Formula C30H24ClN5S
Exact Mass 521.144095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JYukw7O7Bxu
Name 2-({[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1-(2-phenylethyl)-1H-benzimidazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H24ClN5S
InChI InChI=1S/C30H24ClN5S/c31-25-16-8-7-15-24(25)29-33-34-30(36(29)23-13-5-2-6-14-23)37-21-28-32-26-17-9-10-18-27(26)35(28)20-19-22-11-3-1-4-12-22/h1-18H,19-21H2
InChIKey DGPSDJQDSAWXEO-UHFFFAOYSA-N
Molecular Weight 522.070 g/mol
SMILES c1([n](c(SCc2[n](c3ccccc3n2)CCc2ccccc2)nn1)-c1ccccc1)-c1c(Cl)cccc1
SPLASH splash10-00kr-3690210000-b67469a4d6b78fb8134e
Synonyms 2-[[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-1-phenethyl-benzimidazole 2-[[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-1-(2-phenylethyl)benzimidazole
Wiley ID 1454859