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4,8-Dihydro-3,7-dimethyl-1-phenyl-4-thioxopyrazolo[3',4':4,5]thiopyrano[2,3-d]pyrimidin-9(1H)-one
SpectraBase Compound ID 7ner03UQnsP
InChI InChI=1S/C16H12N4OS2/c1-8-11-13(20(19-8)10-6-4-3-5-7-10)12-14(21)17-9(2)18-15(12)23-16(11)22/h3-7H,1-2H3,(H,17,18,21)
InChIKey XLLZLFVJOVTQRY-UHFFFAOYSA-N
Mol Weight 340.42 g/mol
Molecular Formula C16H12N4OS2
Exact Mass 340.045253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Qv59JfZTzB
Name 4,8-Dihydro-3,7-dimethyl-1-phenyl-4-thioxopyrazolo[3',4':4,5]thiopyrano[2,3-d]pyrimidin-9(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N4OS2
InChI InChI=1S/C16H12N4OS2/c1-8-11-13(20(19-8)10-6-4-3-5-7-10)12-14(21)17-9(2)18-15(12)23-16(11)22/h3-7H,1-2H3,(H,17,18,21)
InChIKey XLLZLFVJOVTQRY-UHFFFAOYSA-N
Molecular Weight 340.419 g/mol
SMILES N1C(C2=C(N=C1C)SC(c1c2[n](nc1C)-c1ccccc1)=S)=O
SPLASH splash10-00di-1019000000-429babeb42c5d9c81a33
Source of Spectrum O1-57-1127-3
Synonyms 3,7-Dimethyl-1-phenyl-4-thioxo-4,8-dihydropyrazolo[3',4':4,5]thiino[2,3-d]pyrimidin-9(1H)-one
Wiley ID 1591552