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carbamimidothioic acid, N-[4-(chlorodifluoromethoxy)phenyl]-N'-[(Z)-methyl]-, 1-(2-chlorophenyl)-2,5-dioxo-3-pyrrolidinyl ester
SpectraBase Compound ID 5C4zqiCs5vs
InChI InChI=1S/C19H15Cl2F2N3O3S/c1-24-18(25-11-6-8-12(9-7-11)29-19(21,22)23)30-15-10-16(27)26(17(15)28)14-5-3-2-4-13(14)20/h2-9,15H,10H2,1H3,(H,24,25)
InChIKey YKJIPIIKACNVIC-UHFFFAOYSA-N
Mol Weight 474.31 g/mol
Molecular Formula C19H15Cl2F2N3O3S
Exact Mass 473.017924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HHlXjocFR8
Name 1-[4-[chloro(difluoro)methoxy]phenyl]-2-[1-(2-chlorophenyl)-2,5-diketo-pyrrolidin-3-yl]-3-methyl-isothiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15Cl2F2N3O3S
InChI InChI=1S/C19H15Cl2F2N3O3S/c1-24-18(25-11-6-8-12(9-7-11)29-19(21,22)23)30-15-10-16(27)26(17(15)28)14-5-3-2-4-13(14)20/h2-9,15H,10H2,1H3,(H,24,25)
InChIKey YKJIPIIKACNVIC-UHFFFAOYSA-N
Molecular Weight 474.310 g/mol
SMILES N(\C(SC1C(N(C(C1)=O)c1c(Cl)cccc1)=O)=N/c1ccc(OC(Cl)(F)F)cc1)C
SPLASH splash10-0690-8923000000-bf99fdfd82f7c856e1ea
Synonyms 1-[4-[chloro(difluoro)methoxy]phenyl]-2-[1-(2-chlorophenyl)-2,5-dioxo-pyrrolidin-3-yl]-3-methyl-isothiourea N-[4-[chloro(difluoro)methoxy]phenyl]-N'-methylcarbamimidothioic acid [1-(2-chlorophenyl)-2,5-dioxo-3-pyrrolidinyl] ester [1-(2-chlorophenyl)-2,5-dioxopyrrolidin-3-yl] N-[4-[chloro(difluoro)methoxy]phenyl]-N'-methylcarbamimidothioate
Wiley ID 1448239