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.omerga.-(5-(m-Chlorophenylamino)-1,3,4-thiadiazol-2-thiol)-.omega.-(1H-1,2,4-triazol-1-yl)acetophenone
SpectraBase Compound ID JKEYbnYW44e
InChI InChI=1S/C18H13ClN6OS2/c19-13-7-4-8-14(9-13)22-17-23-24-18(28-17)27-16(25-11-20-10-21-25)15(26)12-5-2-1-3-6-12/h1-11,16H,(H,22,23)
InChIKey ZRURSSWGUCKLNW-UHFFFAOYSA-N
Mol Weight 428.92 g/mol
Molecular Formula C18H13ClN6OS2
Exact Mass 428.028079 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMGJF65P4gN
Name .omerga.-(5-(m-Chlorophenylamino)-1,3,4-thiadiazol-2-thiol)-.omega.-(1H-1,2,4-triazol-1-yl)acetophenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13ClN6OS2
InChI InChI=1S/C18H13ClN6OS2/c19-13-7-4-8-14(9-13)22-17-23-24-18(28-17)27-16(25-11-20-10-21-25)15(26)12-5-2-1-3-6-12/h1-11,16H,(H,22,23)
InChIKey ZRURSSWGUCKLNW-UHFFFAOYSA-N
Molecular Weight 428.916 g/mol
SMILES N(c1sc(nn1)SC(C(c1ccccc1)=O)[n]1ncnc1)c1cccc(c1)Cl
SPLASH splash10-0a4i-0940000000-b6028201ee58184ee8e0
Source of Spectrum Y1-41B-2438-4d
Synonyms 2-[[5-(3-chloroanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenyl-2-(1,2,4-triazol-1-yl)ethanone 2-((5-((3-chlorophenyl)amino)-1,3,4-thiadiazol-2-yl)thio)-1-phenyl-2-(1H-1,2,4-triazol-1-yl)ethanone 2-[[5-[(3-chlorophenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenyl-2-(1,2,4-triazol-1-yl)ethanone
Wiley ID 1744119