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(3-Oxo-3,4-dihydro-2-quinoxalinyl)(phenyl)methyl N-methyl-N'-phenylimidothiocarbamate
SpectraBase Compound ID 7ojZlBx0uN3
InChI InChI=1S/C23H20N4OS/c1-24-23(25-17-12-6-3-7-13-17)29-21(16-10-4-2-5-11-16)20-22(28)27-19-15-9-8-14-18(19)26-20/h2-15,21H,1H3,(H,24,25)(H,27,28)
InChIKey GTEPUXSBSPRABK-UHFFFAOYSA-N
Mol Weight 400.5 g/mol
Molecular Formula C23H20N4OS
Exact Mass 400.135782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1OpAcdAnTPO
Name (3-Oxo-3,4-dihydro-2-quinoxalinyl)(phenyl)methyl N-methyl-N'-phenylimidothiocarbamate
Alternate Name(s) 2-[(3-keto-4H-quinoxalin-2-yl)-phenyl-methyl]-3-methyl-1-phenyl-isothiourea 3-Methyl-2-[(3-oxo-4H-quinoxalin-2-yl)-phenyl-methyl]-1-phenyl-isothiourea 3-[.alpha.-(N-Methyl-N'-phenylamidinothio)benzyl]-1H-2-quinoxalinone N'-methyl-N-phenylcarbamimidothioic acid [(3-oxo-4H-quinoxalin-2-yl)-phenylmethyl] ester [(3-oxo-4H-quinoxalin-2-yl)-phenylmethyl] N'-methyl-N-phenylcarbamimidothioate
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Formula C23H20N4OS
InChI InChI=1S/C23H20N4OS/c1-24-23(25-17-12-6-3-7-13-17)29-21(16-10-4-2-5-11-16)20-22(28)27-19-15-9-8-14-18(19)26-20/h2-15,21H,1H3,(H,24,25)(H,27,28)
InChIKey GTEPUXSBSPRABK-UHFFFAOYSA-N
Molecular Weight 400.500 g/mol
SMILES N1C(C(C(S\C(NC)=N/c2ccccc2)c2ccccc2)=Nc2ccccc12)=O
SPLASH splash10-004u-9300000000-6750f1a10287fcc37d9a
Wiley ID 1470475