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2-(5-(2-butyl-4-chloro-1H-imidazol-5-yl)-1-(4-(4-chlorophenyl)thiazol-2-yl)-4,5-dihydro-1H-pyrazol-3-yl)-4-chloro-5-methylphenol

View entire compound with spectra: 2 MS (GC)

2-(5-(2-butyl-4-chloro-1H-imidazol-5-yl)-1-(4-(4-chlorophenyl)thiazol-2-yl)-4,5-dihydro-1H-pyrazol-3-yl)-4-chloro-5-methylphenol
SpectraBase Compound ID LjSBkI8Ia23
InChI InChI=1S/C26H24Cl3N5OS/c1-3-4-5-23-31-24(25(29)32-23)21-12-19(17-11-18(28)14(2)10-22(17)35)33-34(21)26-30-20(13-36-26)15-6-8-16(27)9-7-15/h6-11,13,21,35H,3-5,12H2,1-2H3,(H,31,32)
InChIKey ZMEKGJVRFLJHIZ-UHFFFAOYSA-N
Mol Weight 560.93 g/mol
Molecular Formula C26H24Cl3N5OS
Exact Mass 559.076715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GE25QCQlsWQ
Name 1-(4-(4'-chlorophenyl)-2-thiazolyl)-3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(2-butyl-4-chloro-1H-imidazol-5yl)-2-pyrazoline
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24Cl3N5OS
InChI InChI=1S/C26H24Cl3N5OS/c1-3-4-5-23-31-24(25(29)32-23)21-12-19(17-11-18(28)14(2)10-22(17)35)33-34(21)26-30-20(13-36-26)15-6-8-16(27)9-7-15/h6-11,13,21,35H,3-5,12H2,1-2H3,(H,31,32)
InChIKey ZMEKGJVRFLJHIZ-UHFFFAOYSA-N
Molecular Weight 560.931 g/mol
SMILES [nH]1c(nc(c1C1N(N=C(c2c(cc(c(c2)Cl)C)O)C1)c1nc(-c2ccc(cc2)Cl)cs1)Cl)CCCC
SPLASH splash10-03xr-0004090000-568a2bfe09d0ce80029d
Source of Spectrum F2-45-390-3e
Wiley ID 1688826