5-methyl-7-(2-methylpropyl)-3-phenylazanyl-2-[(4-phenylphenyl)methyl]pyrazolo[3,4-d]pyrimidine-4,6-dione

Systemtic Name: 5-methyl-7-(2-methylpropyl)-3-phenylazanyl-2-[(4-phenylphenyl)methyl]pyrazolo[3,4-d]pyrimidine-4,6-dione Openeye Name: 3-anilino-7-isobutyl-5-methyl-2-[(4-phenylphenyl)methyl]pyrazolo[3,4-d]pyrimidine-4,6-dione CAS Name: 3-anilino-5-methyl-7-(2-methylpropyl)-2-[(4-phenylphenyl)methyl]pyrazolo[3,4-d]pyrimidine-4,6-dione IUPAC Name: 3-anilino-5-methyl-7-(2-methylpropyl)-2-[(4-phenylphenyl)methyl]pyrazolo[3,4-d]pyrimidine-4,6-dione Traditional Name: 3-anilino-7-isobutyl-5-methyl-2-(4-phenylbenzyl)pyrazolo[3,4-d]pyrimidine-4,6-quinone Formula: C29H29N5O2 MolecularWeight: 479.57286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=NN(C(=C2C(=O)N(C1=O)C)NC3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)CN1C2=NN(C(=C2C(=O)N(C1=O)C)NC3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H29N5O2/c1-20(2)18-33-27-25(28(35)32(3)29(33)36)26(30-24-12-8-5-9-13-24)34(31-27)19-21-14-16-23(17-15-21)22-10-6-4-7-11-22/h4-17,20,30H,18-19H2,1-3H3