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S1-[(1-Benzyl-3-chloro-1,6-dihydro-5-phenyl-6-oxo-2-pyrazinyl)methyl]ethanethioate
SpectraBase Compound ID J6iqMbr8Z1A
InChI InChI=1S/C20H17ClN2O2S/c1-14(24)26-13-17-19(21)22-18(16-10-6-3-7-11-16)20(25)23(17)12-15-8-4-2-5-9-15/h2-11H,12-13H2,1H3
InChIKey FIYFCPJALYBSEH-UHFFFAOYSA-N
Mol Weight 384.88 g/mol
Molecular Formula C20H17ClN2O2S
Exact Mass 384.069927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6g9E00FLSDX
Name S1-[(1-Benzyl-3-chloro-1,6-dihydro-5-phenyl-6-oxo-2-pyrazinyl)methyl]ethanethioate
Alternate Name(s) Ethanethioic acid S-[(1-benzyl-3-chloro-6-keto-5-phenyl-pyrazin-2-yl)methyl]ester Ethanethioic acid S-[[3-chloro-6-oxo-5-phenyl-1-(phenylmethyl)-2-pyrazinyl]methyl]ester S-[(1-benzyl-3-chloro-6-oxo-5-phenyl-1,6-dihydro-2-pyrazinyl)methyl]ethanethioate S-[(1-benzyl-3-chloro-6-oxo-5-phenyl-pyrazin-2-yl)methyl]ethanethioate S-[[3-chloranyl-6-oxidanylidene-5-phenyl-1-(phenylmethyl)pyrazin-2-yl]methyl]ethanethioate Ethanethioic acid S-[[3-chloro-6-oxo-5-phenyl-1-(phenylmethyl)-2-pyrazinyl]methyl] ester S-[(1-benzyl-3-chloro-6-oxo-5-phenylpyrazin-2-yl)methyl] ethanethioate S-[(1-benzyl-3-chloro-6-oxo-5-phenyl-pyrazin-2-yl)methyl] ethanethioate S-[[3-chloranyl-6-oxidanylidene-5-phenyl-1-(phenylmethyl)pyrazin-2-yl]methyl] ethanethioate
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Formula C20H17ClN2O2S
InChI InChI=1S/C20H17ClN2O2S/c1-14(24)26-13-17-19(21)22-18(16-10-6-3-7-11-16)20(25)23(17)12-15-8-4-2-5-9-15/h2-11H,12-13H2,1H3
InChIKey FIYFCPJALYBSEH-UHFFFAOYSA-N
Molecular Weight 384.881 g/mol
SMILES C=1(N(C(C(=NC1Cl)c1ccccc1)=O)Cc1ccccc1)CSC(=O)C
SPLASH splash10-0006-9037000000-54d7d0499ac28e940e64
Source of Spectrum KC-60-434-10
Wiley ID 1583056