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3H-1,2,4-Triazolo[4,3-b][1,2,4]triazole-3-thione, 7-(4-chlorophenyl)-6-[(4-chlorophenyl)amino]-2,7-dihydro-2-methyl-
SpectraBase Compound ID sYPhSutkq1
InChI InChI=1S/C16H12Cl2N6S/c1-22-16(25)24-15(21-22)23(13-8-4-11(18)5-9-13)14(20-24)19-12-6-2-10(17)3-7-12/h2-9H,1H3,(H,19,20)
InChIKey FAQSRBFBEDQRTP-UHFFFAOYSA-N
Mol Weight 391.28 g/mol
Molecular Formula C16H12Cl2N6S
Exact Mass 390.022121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8qK9TQXg4Xb
Name 3H-1,2,4-Triazolo[4,3-b][1,2,4]triazole-3-thione, 7-(4-chlorophenyl)-6-[(4-chlorophenyl)amino]-2,7-dihydro-2-methyl-
CAS Registry Number 116088-31-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12Cl2N6S
InChI InChI=1S/C16H12Cl2N6S/c1-22-16(25)24-15(21-22)23(13-8-4-11(18)5-9-13)14(20-24)19-12-6-2-10(17)3-7-12/h2-9H,1H3,(H,19,20)
InChIKey FAQSRBFBEDQRTP-UHFFFAOYSA-N
Molecular Weight 391.280 g/mol
SMILES N(C1=NN2C(N1c1ccc(cc1)Cl)=NN(C2=S)C)c1ccc(cc1)Cl
SPLASH splash10-0006-1319000000-9616eb81ec6f949ec34f
Source of Spectrum KC-1987-2670-16
Synonyms 6-(4-Chloroanilino)-7-(4-chlorophenyl)-2-methyl-2,7-dihydro-3H-[1,2,4]triazolo[4,3-b][1,2,4]triazole-3-thione 7-(4-Chlorophenyl)-6-(4-chlorophenyl)amino-2-methyltriazolo-triazolethione
Wiley ID 1364538