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Benzoic acid, 4-[[2-[1-(3-chloro-4-methoxyphenyl)-3-cyclopropyl-5-oxo-2-thioxo-4-imidazolidinyl]acetyl]amino]-, ethyl ester
SpectraBase Compound ID 5p9svvPebbT
InChI InChI=1S/C24H24ClN3O5S/c1-3-33-23(31)14-4-6-15(7-5-14)26-21(29)13-19-22(30)28(24(34)27(19)16-8-9-16)17-10-11-20(32-2)18(25)12-17/h4-7,10-12,16,19H,3,8-9,13H2,1-2H3,(H,26,29)
InChIKey BFZOHNCWOYNDIR-UHFFFAOYSA-N
Mol Weight 501.99 g/mol
Molecular Formula C24H24ClN3O5S
Exact Mass 501.11252 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Oiz1zSafsG
Name Benzoic acid, 4-[[2-[1-(3-chloro-4-methoxyphenyl)-3-cyclopropyl-5-oxo-2-thioxo-4-imidazolidinyl]acetyl]amino]-, ethyl ester
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Formula C24H24ClN3O5S
InChI InChI=1S/C24H24ClN3O5S/c1-3-33-23(31)14-4-6-15(7-5-14)26-21(29)13-19-22(30)28(24(34)27(19)16-8-9-16)17-10-11-20(32-2)18(25)12-17/h4-7,10-12,16,19H,3,8-9,13H2,1-2H3,(H,26,29)
InChIKey BFZOHNCWOYNDIR-UHFFFAOYSA-N
Molecular Weight 501.985 g/mol
SMILES N(C(CC1N(C(N(C1=O)c1ccc(c(c1)Cl)OC)=S)C1CC1)=O)c1ccc(C(OCC)=O)cc1
SPLASH splash10-0006-9201000000-14629948798f4db86d49
Source of Spectrum IY-1-4694-8
Synonyms 4-[[2-[1-(3-chloro-4-methoxyphenyl)-3-cyclopropyl-5-oxo-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester Ethyl 4-[[2-[1-(3-chloro-4-methoxyphenyl)-3-cyclopropyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate Ethyl 4-[[2-[1-(3-chloro-4-methoxy-phenyl)-3-cyclopropyl-5-oxo-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoate Ethyl 4-[2-[1-(3-chloranyl-4-methoxy-phenyl)-3-cyclopropyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate
Wiley ID 1654931