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4-Imidazolidinecarbothioamide, 3-(4-chlorophenyl)-2,5-dioxo-N,1,4-triphenyl-
SpectraBase Compound ID p8bB02hh19
InChI InChI=1S/C28H20ClN3O2S/c29-21-16-18-24(19-17-21)32-27(34)31(23-14-8-3-9-15-23)26(33)28(32,20-10-4-1-5-11-20)25(35)30-22-12-6-2-7-13-22/h1-19H,(H,30,35)
InChIKey XAKWYXBVAVKINH-UHFFFAOYSA-N
Mol Weight 498.0 g/mol
Molecular Formula C28H20ClN3O2S
Exact Mass 497.096476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTw09orksFW
Name 4-Imidazolidinecarbothioamide, 3-(4-chlorophenyl)-2,5-dioxo-N,1,4-triphenyl-
CAS Registry Number 72743-01-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H20ClN3O2S
InChI InChI=1S/C28H20ClN3O2S/c29-21-16-18-24(19-17-21)32-27(34)31(23-14-8-3-9-15-23)26(33)28(32,20-10-4-1-5-11-20)25(35)30-22-12-6-2-7-13-22/h1-19H,(H,30,35)
InChIKey XAKWYXBVAVKINH-UHFFFAOYSA-N
Molecular Weight 498.000 g/mol
SMILES N(C(C1(N(C(=O)N(C1=O)c1ccccc1)c1ccc(cc1)Cl)c1ccccc1)=S)c1ccccc1
SPLASH splash10-01si-7913000000-52d8c22d91dcd153f90e
Source of Spectrum O-15-260-1
Synonyms 1-p-chlorophenyl-3,5-diphenyl-imidazolidine-2,4-dione-5-thiocarboxylic acid anilide 3-(4-Chlorophenyl)-2,5-dioxo-N,1,4-triphenyl-4-imidazolidinecarbothioamide
Wiley ID 1398412