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1-(4-(4'-chlorophenyl)-2-thiazolyl)-3-(2-hydroxy-3-iodo-5-methylphenyl)-5-(2-butyl-4-chloro-1H-imidazol-5yl)-2-pyrazoline

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1-(4-(4'-chlorophenyl)-2-thiazolyl)-3-(2-hydroxy-3-iodo-5-methylphenyl)-5-(2-butyl-4-chloro-1H-imidazol-5yl)-2-pyrazoline
SpectraBase Compound ID GgWHxlGP3ZY
InChI InChI=1S/C26H24Cl2IN5OS/c1-3-4-5-22-31-23(25(28)32-22)21-12-19(17-10-14(2)11-18(29)24(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 CIQFMXOTHKPBER-UHFFFAOYSA-N
Mol Weight 652.38 g/mol
Molecular Formula C26H24Cl2IN5OS
Exact Mass 651.012332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3piJSmw37Oj
Name 1-(4-(4'-chlorophenyl)-2-thiazolyl)-3-(2-hydroxy-3-iodo-5-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 C26H24Cl2IN5OS
InChI InChI=1S/C26H24Cl2IN5OS/c1-3-4-5-22-31-23(25(28)32-22)21-12-19(17-10-14(2)11-18(29)24(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 CIQFMXOTHKPBER-UHFFFAOYSA-N
Molecular Weight 652.382 g/mol
SMILES [nH]1c(nc(c1C1N(N=C(c2c(c(cc(c2)C)I)O)C1)c1nc(-c2ccc(cc2)Cl)cs1)Cl)CCCC
SPLASH splash10-0udi-0000009000-b410394c19dda698dec9
Source of Spectrum F2-45-391-3j
Wiley ID 1688822