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6-(4-chlorophenyl)-3-methylsulphanyl-1-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-d]pyrimidin-4-one
SpectraBase Compound ID 9aA6KjgfvZL
InChI InChI=1S/C18H15ClN4OS/c1-25-18-14-16(23(22-18)13-5-3-2-4-6-13)20-15(21-17(14)24)11-7-9-12(19)10-8-11/h2-10,15,20H,1H3,(H,21,24)
InChIKey OJARTGZWKCSMNB-UHFFFAOYSA-N
Mol Weight 370.86 g/mol
Molecular Formula C18H15ClN4OS
Exact Mass 370.06551 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8VPHYE8HHjw
Name 6-(4-chlorophenyl)-3-methylsulphanyl-1-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-d]pyrimidin-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H15ClN4OS
InChI InChI=1S/C18H15ClN4OS/c1-25-18-14-16(23(22-18)13-5-3-2-4-6-13)20-15(21-17(14)24)11-7-9-12(19)10-8-11/h2-10,15,20H,1H3,(H,21,24)
InChIKey OJARTGZWKCSMNB-UHFFFAOYSA-N
Molecular Weight 370.858 g/mol
SMILES N1C(c2c([n](nc2SC)-c2ccccc2)NC1c1ccc(cc1)Cl)=O
SPLASH splash10-0udi-9006000000-e2a388718f9dfce230be
Source of Spectrum F2-45-5288-5c
Wiley ID 1703590