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4H-1,2,4-Triazol-4-amine, 3-(2,4-dichlorophenyl)-5-(2,4,6-trimethylbenzylthio)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4H-1,2,4-Triazol-4-amine, 3-(2,4-dichlorophenyl)-5-(2,4,6-trimethylbenzylthio)-
SpectraBase Compound ID IOnBZorYDvF
InChI InChI=1S/C18H18Cl2N4S/c1-10-6-11(2)15(12(3)7-10)9-25-18-23-22-17(24(18)21)14-5-4-13(19)8-16(14)20/h4-8H,9,21H2,1-3H3
InChIKey KMZLBTCGCXKODM-UHFFFAOYSA-N
Mol Weight 393.34 g/mol
Molecular Formula C18H18Cl2N4S
Exact Mass 392.062923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HpJlXVxv0NN
Name 4H-1,2,4-Triazol-4-amine, 3-(2,4-dichlorophenyl)-5-(2,4,6-trimethylbenzylthio)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18Cl2N4S
InChI InChI=1S/C18H18Cl2N4S/c1-10-6-11(2)15(12(3)7-10)9-25-18-23-22-17(24(18)21)14-5-4-13(19)8-16(14)20/h4-8H,9,21H2,1-3H3
InChIKey KMZLBTCGCXKODM-UHFFFAOYSA-N
Molecular Weight 393.336 g/mol
SMILES N[n]1c(nnc1SCc1c(cc(cc1C)C)C)-c1c(cc(cc1)Cl)Cl
SPLASH splash10-001i-2900000000-df034dc11ff6d40abbcd
Source of Spectrum AD-0-2532-0
Synonyms 3-(2,4-dichlorophenyl)-5-[(2,4,6-trimethylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine 3-(2,4-dichlorophenyl)-5-[(2,4,6-trimethylphenyl)methylthio]-1,2,4-triazol-4-amine 3-(2,4-Dichlorophenyl)-5-[(mesitylmethyl)sulfanyl]-4H-1,2,4-triazol-4-amine [3-(2,4-dichlorophenyl)-5-[(2,4,6-trimethylbenzyl)thio]-1,2,4-triazol-4-yl]amine
Wiley ID 1432753