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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3CC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3CC4=CC=C(C=C4)C

InChI

InChI=1S/C21H21N5/c1-3-16-8-10-18(11-9-16)25-20-19-12-24-26(21(19)23-14-22-20)13-17-6-4-15(2)5-7-17/h4-12,14H,3,13H2,1-2H3,(H,22,23,25)