1-(2,4-dimethylphenyl)-N-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(2,4-dimethylphenyl)-N-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(2,4-dimethylphenyl)-N-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(2,4-dimethylphenyl)-N-phenethyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(2,4-dimethylphenyl)-N-phenethylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-phenethyl-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)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C21H21N5/c1-15-8-9-19(16(2)12-15)26-21-18(13-25-26)20(23-14-24-21)22-11-10-17-6-4-3-5-7-17/h3-9,12-14H,10-11H2,1-2H3,(H,22,23,24)