skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > azole > diazole > pyrazoles > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > azole > diazole > pyrazoles > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > azole > diazole > pyrazoles > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > azole > diazole > pyrazoles > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > heteroarene > monocyclic heteroarene > azole > diazole > pyrazoles > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > heteroarene > monocyclic heteroarene > azole > diazole > pyrazoles > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-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 > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > heteroarene > monocyclic heteroarene > azole > diazole > pyrazoles > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > heteroarene > monocyclic heteroarene > azole > diazole > pyrazoles > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > heteroarene > monocyclic heteroarene > azole > diazole > pyrazoles > 1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one

Preferred term

1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2h-quinolin-1-yl)-2-oxoethyl]thio]-2h-pyrazolo[3,4-d]pyrimidin-4-one  

Type

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

Broader concept

charge

  • 0

formula

  • C22H18ClN5O2S

inchi

  • InChI=1S/C22H18ClN5O2S/c23-15-7-9-16(10-8-15)28-20-17(12-24-28)21(30)26-22(25-20)31-13-19(29)27-11-3-5-14-4-1-2-6-18(14)27/h1-2,4,6-10,12,24H,3,5,11,13H2

inchikey

  • XORMCTHDSXXHCH-UHFFFAOYSA-N

mass

  • 451.930

monoisotopicmass

  • 451.08697

smiles

  • C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NC(=O)C4=CNN(C4=N3)C5=CC=C(C=C5)Cl

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:123444

Download this concept:

RDF/XML TURTLE JSON-LD