1-(2,3-dimethylphenyl)-5-(diphenylmethyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(2,3-dimethylphenyl)-5-(diphenylmethyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-benzhydryl-1-(2,3-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(2,3-dimethylphenyl)-5-(diphenylmethyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-benzhydryl-1-(2,3-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-benzhydryl-1-(2,3-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C26H22N4O MolecularWeight: 406.47908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C3=C(C=N2)C(=O)N(C=N3)C(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C3=C(C=N2)C(=O)N(C=N3)C(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C26H22N4O/c1-18-10-9-15-23(19(18)2)30-25-22(16-28-30)26(31)29(17-27-25)24(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-17,24H,1-2H3