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

Systemtic Name: 1-(3,4-dimethylphenyl)-N-(4-ethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(3,4-dimethylphenyl)-N-(4-ethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(3,4-dimethylphenyl)-N-(4-ethoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(3,4-dimethylphenyl)-N-(4-ethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-p-phenetyl-amine Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3C4=CC(=C(C=C4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C21H21N5O/c1-4-27-18-9-6-16(7-10-18)25-20-19-12-24-26(21(19)23-13-22-20)17-8-5-14(2)15(3)11-17/h5-13H,4H2,1-3H3,(H,22,23,25)