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5-[(2-chlorophenyl)methylsulfanyl]-N,4-diphenyl-1,2,4-triazol-3-amine
SpectraBase Compound ID JogUq3tGjvK
InChI InChI=1S/C21H17ClN4S/c22-19-14-8-7-9-16(19)15-27-21-25-24-20(23-17-10-3-1-4-11-17)26(21)18-12-5-2-6-13-18/h1-14H,15H2,(H,23,24)
InChIKey NCBFKXQWLKELKF-UHFFFAOYSA-N
Mol Weight 392.91 g/mol
Molecular Formula C21H17ClN4S
Exact Mass 392.086245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H8bG25UYXPC
Name 5-[(2-chlorophenyl)methylsulfanyl]-N,4-diphenyl-1,2,4-triazol-3-amine
Alternate Name(s) 5-[(2-chlorophenyl)methylthio]-N,4-diphenyl-1,2,4-triazol-3-amine [5-[(2-chlorobenzyl)thio]-4-phenyl-1,2,4-triazol-3-yl]-phenyl-amine
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Formula C21H17ClN4S
InChI InChI=1S/C21H17ClN4S/c22-19-14-8-7-9-16(19)15-27-21-25-24-20(23-17-10-3-1-4-11-17)26(21)18-12-5-2-6-13-18/h1-14H,15H2,(H,23,24)
InChIKey NCBFKXQWLKELKF-UHFFFAOYSA-N
Molecular Weight 392.908 g/mol
SMILES N(c1[n](c(SCc2c(Cl)cccc2)nn1)-c1ccccc1)c1ccccc1
SPLASH splash10-004i-9622000000-c26fb226d4343d4e8960
Wiley ID 1447035