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3-(1-p-Chlorophenyl-5-methyl-1,2,3-triazol-4-yl)-4-(4-methoxyphenyl)-1,2,4-triazol-5-thione
SpectraBase Compound ID JHLM6Lyzj8A
InChI InChI=1S/C18H15ClN6OS/c1-11-16(20-23-25(11)14-5-3-12(19)4-6-14)17-21-22-18(27)24(17)13-7-9-15(26-2)10-8-13/h3-10H,1-2H3,(H,22,27)
InChIKey VHEOUPNJUKQOCG-UHFFFAOYSA-N
Mol Weight 398.87 g/mol
Molecular Formula C18H15ClN6OS
Exact Mass 398.071658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qeONTzlhFZ
Name 3-(1-p-Chlorophenyl-5-methyl-1,2,3-triazol-4-yl)-4-(4-methoxyphenyl)-1,2,4-triazol-5-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15ClN6OS
InChI InChI=1S/C18H15ClN6OS/c1-11-16(20-23-25(11)14-5-3-12(19)4-6-14)17-21-22-18(27)24(17)13-7-9-15(26-2)10-8-13/h3-10H,1-2H3,(H,22,27)
InChIKey VHEOUPNJUKQOCG-UHFFFAOYSA-N
Molecular Weight 398.872 g/mol
SMILES N1N=C(N(C1=S)c1ccc(cc1)OC)c1c(C)[n](nn1)-c1ccc(cc1)Cl
SPLASH splash10-0002-0319200000-81d5be068226d20de91e
Source of Spectrum Y1-38B-4-6e
Synonyms 5-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-(4-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione 3-(1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl)-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5(4H)-thione 3-[1-(4-chlorophenyl)-5-methyl-4-triazolyl]-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione 3-[1-(4-chlorophenyl)-5-methyltriazol-4-yl]-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione 3-[1-(4-chlorophenyl)-5-methyl-1,2,3-triazol-4-yl]-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione
Wiley ID 1743916