5-(4-methylphenyl)-6-[(4-methylphenyl)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(4-methylphenyl)-6-[(4-methylphenyl)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(4-methylanilino)-1-phenyl-5-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(4-methylanilino)-5-(4-methylphenyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 6-(4-methylanilino)-5-(4-methylphenyl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-phenyl-6-(p-toluidino)-5-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H21N5O MolecularWeight: 407.46714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC3=C(C=NN3C4=CC=CC=C4)C(=O)N2C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC3=C(C=NN3C4=CC=CC=C4)C(=O)N2C5=CC=C(C=C5)C

InChI

InChI=1S/C25H21N5O/c1-17-8-12-19(13-9-17)27-25-28-23-22(16-26-30(23)21-6-4-3-5-7-21)24(31)29(25)20-14-10-18(2)11-15-20/h3-16H,1-2H3,(H,27,28)