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

Systemtic Name: 1-(3,4-dimethylphenyl)-N-(3-phenylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(3,4-dimethylphenyl)-N-(3-phenylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(3,4-dimethylphenyl)-N-(3-phenylpropyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(3,4-dimethylphenyl)-N-(3-phenylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-(3-phenylpropyl)amine Formula: C22H23N5 MolecularWeight: 357.45152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5/c1-16-10-11-19(13-17(16)2)27-22-20(14-26-27)21(24-15-25-22)23-12-6-9-18-7-4-3-5-8-18/h3-5,7-8,10-11,13-15H,6,9,12H2,1-2H3,(H,23,24,25)