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Methyl N'-((Z,Z)-anilino([(Z)-(4-chlorophenyl)(oxo)methyl]imino)methyl)-N-phenylimidothiocarbamate
SpectraBase Compound ID 82aXU40MNHs
InChI InChI=1S/C22H19ClN4OS/c1-29-22(25-19-10-6-3-7-11-19)27-21(24-18-8-4-2-5-9-18)26-20(28)16-12-14-17(23)15-13-16/h2-15H,1H3,(H2,24,25,26,27,28)
InChIKey QZGHKCWPBHANRV-UHFFFAOYSA-N
Mol Weight 422.93 g/mol
Molecular Formula C22H19ClN4OS
Exact Mass 422.09681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LxRjq4XLQRt
Name Methyl N'-((Z,Z)-anilino([(Z)-(4-chlorophenyl)(oxo)methyl]imino)methyl)-N-phenylimidothiocarbamate
Alternate Name(s) Carbamimidothioic acid, [[(4-chlorobenzoyl)amino](phenylamino)methylene]phenyl-, methyl ester Methyl N'-[N'-(4-chlorobenzoyl)-N-phenylcarbamimidoyl]-N-phenylcarbamimidothioate Methyl N'-[N'-(4-chlorophenyl)carbonyl-N-phenyl-carbamimidoyl]-N-phenyl-carbamimidothioate N'-[anilino-[(4-chlorophenyl)-oxomethyl]iminomethyl]-N-phenylcarbamimidothioic acid methyl ester N-[anilino-[(Z)-[anilino(methylsulfanyl)methylene]amino]methylene]-4-chloro-benzamide N-[anilino-[(Z)-[anilino-(methylthio)methylene]amino]methylene]-4-chloro-benzamide
CAS Registry Number 79340-17-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19ClN4OS
InChI InChI=1S/C22H19ClN4OS/c1-29-22(25-19-10-6-3-7-11-19)27-21(24-18-8-4-2-5-9-18)26-20(28)16-12-14-17(23)15-13-16/h2-15H,1H3,(H2,24,25,26,27,28)
InChIKey QZGHKCWPBHANRV-UHFFFAOYSA-N
Molecular Weight 422.934 g/mol
SMILES N(\C(\N=C\(Nc1ccccc1)SC)=N\C(=O)c1ccc(cc1)Cl)c1ccccc1
SPLASH splash10-002v-6912000000-46f0bd8e6d97229f0639
Wiley ID 1501222