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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > heteroarene > monocyclic heteroarene > azole > diazole > pyrazoles > 6-[(1,3-benzoxazol-2-ylthio)methyl]-1-phenyl-2h-pyrazolo[3,4-d]pyrimidin-4-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > heteroarene > monocyclic heteroarene > azole > diazole > pyrazoles > 6-[(1,3-benzoxazol-2-ylthio)methyl]-1-phenyl-2h-pyrazolo[3,4-d]pyrimidin-4-one

Preferred term

6-[(1,3-benzoxazol-2-ylthio)methyl]-1-phenyl-2h-pyrazolo[3,4-d]pyrimidin-4-one  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C19H13N5O2S

inchi

  • InChI=1S/C19H13N5O2S/c25-18-13-10-20-24(12-6-2-1-3-7-12)17(13)22-16(23-18)11-27-19-21-14-8-4-5-9-15(14)26-19/h1-10,20H,11H2

inchikey

  • GIYZZPVSSGAUSW-UHFFFAOYSA-N

mass

  • 375.406

monoisotopicmass

  • 375.07900

smiles

  • C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)CSC4=NC5=CC=CC=C5O4

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:111277

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