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Thiourea, N-(3-chloro-4-fluorophenyl)-N'-[2-(1H-imidazol-4-yl)ethyl]-
SpectraBase Compound ID 5pPqfJ3vyt9
InChI InChI=1S/C12H12ClFN4S/c13-10-5-8(1-2-11(10)14)18-12(19)16-4-3-9-6-15-7-17-9/h1-2,5-7H,3-4H2,(H,15,17)(H2,16,18,19)
InChIKey RDMLLSVCGFVNKP-UHFFFAOYSA-N
Mol Weight 298.77 g/mol
Molecular Formula C12H12ClFN4S
Exact Mass 298.045523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FWqV3DZ38ah
Name Thiourea, N-(3-chloro-4-fluorophenyl)-N'-[2-(1H-imidazol-4-yl)ethyl]-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12ClFN4S
InChI InChI=1S/C12H12ClFN4S/c13-10-5-8(1-2-11(10)14)18-12(19)16-4-3-9-6-15-7-17-9/h1-2,5-7H,3-4H2,(H,15,17)(H2,16,18,19)
InChIKey RDMLLSVCGFVNKP-UHFFFAOYSA-N
Molecular Weight 298.767 g/mol
SMILES N(C(=S)NCCc1c[nH]cn1)c1cc(c(F)cc1)Cl
SPLASH splash10-001j-9500000000-fc5ca8cca80558917200
Source of Spectrum IY-1-4517-9
Synonyms 1-(3-Chloro-4-fluorophenyl)-3-[2-(1H-imidazol-5-yl)ethyl]thiourea 1-(3-Chloranyl-4-fluoranyl-phenyl)-3-[2-(1H-imidazol-5-yl)ethyl]thiourea
Wiley ID 1653162