CHEBI:115616 - 6-(butan-2-ylthio)-1-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

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ChEBI Name 6-(butan-2-ylthio)-1-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one
ChEBI ID CHEBI:115616
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H18N4OS
Net Charge 0
Average Mass 314.407
Monoisotopic Mass 314.12013
InChI InChI=1S/C16H18N4OS/c1-4-11(3)22-16-18-14-13(15(21)19-16)9-17-20(14)12-7-5-10(2)6-8-12/h5-9,11,17H,4H2,1-3H3
InChIKey DKRXLDZLVCGMER-UHFFFAOYSA-N
SMILES CCC(C)SC1=NC(=O)C2=CNN(C2=N1)C3=CC=C(C=C3)C
ChEBI Ontology
Outgoing 6-(butan-2-ylthio)-1-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one (CHEBI:115616) is a pyrazoles (CHEBI:26410)
6-(butan-2-ylthio)-1-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one (CHEBI:115616) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-27073 LINCS
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