CHEBI:105788 - N-(3-chlorophenyl)-2-[1-(3,4-dimethylphenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]acetamide

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ChEBI Name N-(3-chlorophenyl)-2-[1-(3,4-dimethylphenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]acetamide
ChEBI ID CHEBI:105788
Stars This entity has been manually annotated by a third party.
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Formula C21H18ClN5O2
Net Charge 0
Average Mass 407.854
Monoisotopic Mass 407.11490
InChI InChI=1S/C21H18ClN5O2/c1-13-6-7-17(8-14(13)2)27-20-18(10-24-27)21(29)26(12-23-20)11-19(28)25-16-5-3-4-15(22)9-16/h3-10,12H,11H2,1-2H3,(H,25,28)
InChIKey ZCWDKCQSVXFIKL-UHFFFAOYSA-N
SMILES CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=CC(=CC=C4)Cl)C
ChEBI Ontology
Outgoing N-(3-chlorophenyl)-2-[1-(3,4-dimethylphenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]acetamide (CHEBI:105788) is a pyrazoles (CHEBI:26410)
N-(3-chlorophenyl)-2-[1-(3,4-dimethylphenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]acetamide (CHEBI:105788) is a ring assembly (CHEBI:36820)
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