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N-(4-chlorophenyl)-N'-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]urea

View entire compound with spectra: 2 NMR

N-(4-chlorophenyl)-N'-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]urea
SpectraBase Compound ID Dq7PUTeUIPx
InChI InChI=1S/C22H22ClN3OS/c23-18-10-12-19(13-11-18)24-21(27)26-22-25-20(14-28-22)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h6-15H,1-5H2,(H2,24,25,26,27)
InChIKey HFEFSMQCNVSKMF-UHFFFAOYSA-N
Mol Weight 411.95 g/mol
Molecular Formula C22H22ClN3OS
Exact Mass 411.117211 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HO5kIZWy7Ks
Name N-(4-Chlorophenyl)-N'-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]urea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 411.117211213 u
Formula C22H22ClN3OS
InChI InChI=1S/C22H22ClN3OS/c23-18-10-12-19(13-11-18)24-21(27)26-22-25-20(14-28-22)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h6-15H,1-5H2,(H2,24,25,26,27)
InChIKey HFEFSMQCNVSKMF-UHFFFAOYSA-N
Molecular Weight 411.951 g/mol
SMILES N(C(=O)NC1=NC(=CS1)C=1C=CC(=CC1)C1CCCCC1)C1=CC=C(C=C1)Cl