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S-Butyl N-(2,6-dimethylphenyl)-1-(2,6-dimethylphenyl)-4,4-diphenyl-2-imidazolin-5-thone-2-thiocarboximidate
SpectraBase Compound ID pBs2VsVfAy
InChI InChI=1S/C36H37N3S2/c1-6-7-24-41-34(37-31-25(2)16-14-17-26(31)3)33-38-36(29-20-10-8-11-21-29,30-22-12-9-13-23-30)35(40)39(33)32-27(4)18-15-19-28(32)5/h8-23H,6-7,24H2,1-5H3/b37-34-
InChIKey KBHCIRLZROKZDR-LLLYXHGFSA-N
Mol Weight 575.8 g/mol
Molecular Formula C36H37N3S2
Exact Mass 575.242891 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6eoGskLywTt
Name S-Butyl N-(2,6-dimethylphenyl)-1-(2,6-dimethylphenyl)-4,4-diphenyl-2-imidazolin-5-thone-2-thiocarboximidate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H37N3S2
InChI InChI=1S/C36H37N3S2/c1-6-7-24-41-34(37-31-25(2)16-14-17-26(31)3)33-38-36(29-20-10-8-11-21-29,30-22-12-9-13-23-30)35(40)39(33)32-27(4)18-15-19-28(32)5/h8-23H,6-7,24H2,1-5H3/b37-34-
InChIKey KBHCIRLZROKZDR-LLLYXHGFSA-N
Molecular Weight 575.833 g/mol
SMILES C=1(N(C(C(N1)(c1ccccc1)c1ccccc1)=S)c1c(cccc1C)C)\C(=N\c1c(cccc1C)C)SCCCC
SPLASH splash10-02vr-0001290000-7438fcda71d402bc916e
Source of Spectrum F-53-13676-25
Synonyms 1,N-Bis-(2,6-dimethyl-phenyl)-4,4-diphenyl-5-thioxo-4,5-dihydro-1H-imidazole-2-carboximidothioic acid butyl ester Butyl N,1-bis(2,6-dimethylphenyl)-4,4-diphenyl-5-thioxo-4,5-dihydro-1H-imidazole-2-carbimidothioate S-Butyl N-(2,6-dimethylphenyl)-1-(2,6-dimethylphenyl)-4,4-diphenyl-2-imidazolin-5-thioxo-2-thiocarboximidate
Wiley ID 803875