3-[[5-(4-chlorophenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-yl]sulfanyl]propane-1-thiol

SpectraBase Compound ID	2exigL8g6fs
InChI	InChI=1S/C14H14ClN5S2/c15-11-4-2-10(3-5-11)12-13(20-9-16-8-17-20)14(19-18-12)22-7-1-6-21/h2-5,8-9,21H,1,6-7H2,(H,18,19)
InChIKey	RBFIKTMLYWSLOB-UHFFFAOYSA-N Google Search
Mol Weight	351.87 g/mol
Molecular Formula	C14H14ClN5S2
Exact Mass	351.037916 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	6FhLCsaQ3o2
Name	3-[[5-(4-chlorophenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-yl]sulfanyl]propane-1-thiol
Alternate Name(s)	3-[[5-(4-chlorophenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-yl]thio]-1-propanethiol 3-[[5-(4-chlorophenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-yl]thio]propane-1-thiol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C14H14ClN5S2
InChI	InChI=1S/C14H14ClN5S2/c15-11-4-2-10(3-5-11)12-13(20-9-16-8-17-20)14(19-18-12)22-7-1-6-21/h2-5,8-9,21H,1,6-7H2,(H,18,19)
InChIKey	RBFIKTMLYWSLOB-UHFFFAOYSA-N
Molecular Weight	351.874 g/mol
SMILES	[nH]1nc(c(c1SCCCS)-[n]1ncnc1)-c1ccc(cc1)Cl
SPLASH	splash10-002n-9421000000-90695bf5ba7711052baf
Source of Spectrum	SK-26-3118-3
Wiley ID	867394