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3H-1,2,4-Triazol-3-one, 5-[[[(2-cyclohexyl-4-thiazolyl)methyl]thio]methyl]-2,4-dihydro-
SpectraBase Compound ID Bd87nquecDv
InChI InChI=1S/C13H18N4OS2/c18-13-15-11(16-17-13)8-19-6-10-7-20-12(14-10)9-4-2-1-3-5-9/h7,9H,1-6,8H2,(H2,15,16,17,18)
InChIKey UMECILAYXONBPX-UHFFFAOYSA-N
Mol Weight 310.43 g/mol
Molecular Formula C13H18N4OS2
Exact Mass 310.092204 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B99U2T1YhJy
Name 3H-1,2,4-Triazol-3-one, 5-[[[(2-cyclohexyl-4-thiazolyl)methyl]thio]methyl]-2,4-dihydro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N4OS2
InChI InChI=1S/C13H18N4OS2/c18-13-15-11(16-17-13)8-19-6-10-7-20-12(14-10)9-4-2-1-3-5-9/h7,9H,1-6,8H2,(H2,15,16,17,18)
InChIKey UMECILAYXONBPX-UHFFFAOYSA-N
Molecular Weight 310.434 g/mol
SMILES N1N=C(NC1=O)CSCc1nc(C2CCCCC2)sc1
SPLASH splash10-001i-4910000000-9e984925113944c5e459
Source of Spectrum IY-1-4412-5
Synonyms 5-[[(2-cyclohexyl-4-thiazolyl)methylthio]methyl]-1,2-dihydro-1,2,4-triazol-3-one 5-[(2-cyclohexylthiazol-4-yl)methylsulfanylmethyl]-1,2-dihydro-1,2,4-triazol-3-one 5-[(2-cyclohexyl-1,3-thiazol-4-yl)methylsulfanylmethyl]-1,2-dihydro-1,2,4-triazol-3-one
Wiley ID 1652108