CHEBI:109066 - 6-[[(4-chlorophenyl)thio]methyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-[[(4-chlorophenyl)thio]methyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione
ChEBI ID CHEBI:109066
Stars This entity has been manually annotated by a third party.
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Formula C19H14ClN3O2S
Net Charge 0
Average Mass 383.853
Monoisotopic Mass 383.04953
InChI InChI=1S/C19H14ClN3O2S/c20-12-6-8-15(9-7-12)26-11-13-10-16(24)17-18(21-13)22-23(19(17)25)14-4-2-1-3-5-14/h1-10H,11H2,(H2,21,22,24)
InChIKey UDYYPRWBKNVMLH-UHFFFAOYSA-N
SMILES C1=CC=C(C=C1)N2C(=O)C3=C(N2)NC(=CC3=O)CSC4=CC=C(C=C4)Cl
ChEBI Ontology
Outgoing 6-[[(4-chlorophenyl)thio]methyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione (CHEBI:109066) is a pyrazoles (CHEBI:26410)
6-[[(4-chlorophenyl)thio]methyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione (CHEBI:109066) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-20464 LINCS
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