For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-[(4',6'-Dimethyl-1H-pyrazolo[3,4-b]pyridin-3'-yl)hydrazono]-2-thioxopyrimidine-4,6-(1H,3H,5H)-dione
SpectraBase Compound ID 5MTL0xo4Nxo
InChI InChI=1S/C12H11N7O2S/c1-4-3-5(2)13-8-6(4)9(19-17-8)18-16-7-10(20)14-12(22)15-11(7)21/h3H,1-2H3,(H2,13,17,18,19)(H2,14,15,20,21,22)
InChIKey ZUHIPSZKHQQZFS-UHFFFAOYSA-N
Mol Weight 317.33 g/mol
Molecular Formula C12H11N7O2S
Exact Mass 317.069494 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1ZxtAZnUem
Name 5-[(4',6'-Dimethyl-1H-pyrazolo[3,4-b]pyridin-3'-yl)hydrazono]-2-thioxopyrimidine-4,6-(1H,3H,5H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N7O2S
InChI InChI=1S/C12H11N7O2S/c1-4-3-5(2)13-8-6(4)9(19-17-8)18-16-7-10(20)14-12(22)15-11(7)21/h3H,1-2H3,(H2,13,17,18,19)(H2,14,15,20,21,22)
InChIKey ZUHIPSZKHQQZFS-UHFFFAOYSA-N
Molecular Weight 317.327 g/mol
SMILES N1C(NC(C(=NNc2n[nH]c3c2c(cc(n3)C)C)C1=O)=O)=S
SPLASH splash10-02t9-0904000000-92254e6695617048b825
Source of Spectrum K1-2003-1549-5
Synonyms 5-[(4,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-yl)hydrazono]-2-thioxo-hexahydropyrimidine-4,6-dione 5-[(4,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-yl)hydrazinylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Wiley ID 1521017