1-(4-methylphenyl)-N-(3-phenylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(4-methylphenyl)-N-(3-phenylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-phenylpropyl)-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(4-methylphenyl)-N-(3-phenylpropyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(4-methylphenyl)-N-(3-phenylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 3-phenylpropyl-[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C21H21N5 MolecularWeight: 343.42494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCCC4=CC=CC=C4

InChI

InChI=1S/C21H21N5/c1-16-9-11-18(12-10-16)26-21-19(14-25-26)20(23-15-24-21)22-13-5-8-17-6-3-2-4-7-17/h2-4,6-7,9-12,14-15H,5,8,13H2,1H3,(H,22,23,24)