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1,3,6-TRIMETHYL-2,4-DIOXO-7-PHENYLTHIO-CARBAMOYL-PTERIDINE
SpectraBase Compound ID 41zM6QD8SgI
InChI InChI=1S/C16H15N5O2S/c1-9-11(14(24)18-10-7-5-4-6-8-10)19-13-12(17-9)15(22)21(3)16(23)20(13)2/h4-8H,1-3H3,(H,18,24)
InChIKey CVHAHRMJIUVOET-UHFFFAOYSA-N
Mol Weight 341.39 g/mol
Molecular Formula C16H15N5O2S
Exact Mass 341.094646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C802diFhcgi
Name 1,3,6-trimethyl-2,4-bis(oxidanylidene)-N-phenyl-pteridine-7-carbothioamide
Alternate Name(s) 1,3,6-trimethyl-2,4-dioxo-N-phenyl-7-pteridinecarbothioamide 1,3,6-trimethyl-2,4-dioxo-N-phenyl-pteridine-7-carbothioamide 2,4-Diketo-1,3,6-trimethyl-N-phenyl-pteridine-7-carbothioamide
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Formula C16H15N5O2S
InChI InChI=1S/C16H15N5O2S/c1-9-11(14(24)18-10-7-5-4-6-8-10)19-13-12(17-9)15(22)21(3)16(23)20(13)2/h4-8H,1-3H3,(H,18,24)
InChIKey CVHAHRMJIUVOET-UHFFFAOYSA-N
Molecular Weight 341.389 g/mol
SMILES N(C(c1c(nc2C(N(C(N(c2n1)C)=O)C)=O)C)=S)c1ccccc1
SPLASH splash10-052f-0009000000-fa766ae7731cf19967a1
Source of Spectrum J-67-4529-7
Wiley ID 1570210