5-(2-methylphenyl)-6-[(2-methylphenyl)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(2-methylphenyl)-6-[(2-methylphenyl)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(2-methylanilino)-5-(o-tolyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(2-methylanilino)-5-(2-methylphenyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 6-(2-methylanilino)-5-(2-methylphenyl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(o-toluidino)-5-(o-tolyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H21N5O MolecularWeight: 407.46714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC3=C(C=NN3C4=CC=CC=C4)C(=O)N2C5=CC=CC=C5C

Isomeric SMILES

CC1=CC=CC=C1NC2=NC3=C(C=NN3C4=CC=CC=C4)C(=O)N2C5=CC=CC=C5C

InChI

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