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S-Methyl (E)-anilino([(E)-(4-methylphenyl)(oxo)methyl]imino)methylthiocarbamate
SpectraBase Compound ID JMKimeYe8jt
InChI InChI=1S/C17H17N3O2S/c1-12-8-10-13(11-9-12)15(21)19-16(20-17(22)23-2)18-14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,18,19,20,21,22)
InChIKey AJMHDJQNUCEKJF-UHFFFAOYSA-N
Mol Weight 327.4 g/mol
Molecular Formula C17H17N3O2S
Exact Mass 327.104148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KklpYp7tsoV
Name S-Methyl (E)-anilino([(E)-(4-methylphenyl)(oxo)methyl]imino)methylthiocarbamate
CAS Registry Number 79340-27-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17N3O2S
InChI InChI=1S/C17H17N3O2S/c1-12-8-10-13(11-9-12)15(21)19-16(20-17(22)23-2)18-14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,18,19,20,21,22)
InChIKey AJMHDJQNUCEKJF-UHFFFAOYSA-N
Molecular Weight 327.402 g/mol
SMILES N(\C(=N/C(c1ccc(cc1)C)=O)NC(=O)SC)c1ccccc1
SPLASH splash10-0159-9750000000-5da5d9f2e60341b83d51
Source of Spectrum HE-1982-0-0
Synonyms (NE)-N-[anilino-(p-toluoylamino)methylene]thiocarbamic acid S-methyl ester (NE)-N-[anilino-[[(4-methylphenyl)-oxomethyl]amino]methylidene]carbamothioic acid S-methyl ester (NZ)-N-[anilino-(p-toluoylamino)methylene]thiocarbamic acid S-methyl ester (NZ)-N-[anilino-[[(4-methylphenyl)-oxomethyl]amino]methylidene]carbamothioic acid S-methyl ester Carbamothioic acid, [[(4-methylbenzoyl)amino](phenylamino)methylene]-, S-methyl ester S-methyl (NE)-N-[anilino-[(4-methylbenzoyl)amino]methylene]carbamothioate S-methyl (NE)-N-[anilino-[(4-methylbenzoyl)amino]methylidene]carbamothioate S-methyl (NE)-N-[[(4-methylphenyl)carbonylamino]-phenylazanyl-methylidene]carbamothioate S-methyl (NZ)-N-[anilino-[(4-methylbenzoyl)amino]methylene]carbamothioate S-methyl (NZ)-N-[anilino-[(4-methylbenzoyl)amino]methylidene]carbamothioate S-methyl (NZ)-N-[[(4-methylphenyl)carbonylamino]-phenylazanyl-methylidene]carbamothioate
Wiley ID 1325459