3-azanyl-5-(4-methylphenyl)-6-[(4-methylphenyl)amino]-2-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-5-(4-methylphenyl)-6-[(4-methylphenyl)amino]-2-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3-amino-6-(4-methylanilino)-2-phenyl-5-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3-amino-6-(4-methylanilino)-5-(4-methylphenyl)-2-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 3-amino-6-(4-methylanilino)-5-(4-methylphenyl)-2-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3-amino-2-phenyl-6-(p-toluidino)-5-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H22N6O MolecularWeight: 422.48178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC3=NN(C(=C3C(=O)N2C4=CC=C(C=C4)C)N)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC3=NN(C(=C3C(=O)N2C4=CC=C(C=C4)C)N)C5=CC=CC=C5

InChI

InChI=1S/C25H22N6O/c1-16-8-12-18(13-9-16)27-25-28-23-21(22(26)31(29-23)20-6-4-3-5-7-20)24(32)30(25)19-14-10-17(2)11-15-19/h3-15H,26H2,1-2H3,(H,27,28,29)