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

Systemtic Name: 1-(3-methylphenyl)-N-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(m-tolyl)-N-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(3-methylphenyl)-N-(4-phenoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(3-methylphenyl)-N-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(m-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]-(4-phenoxyphenyl)amine Formula: C24H19N5O MolecularWeight: 393.44056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C24H19N5O/c1-17-6-5-7-19(14-17)29-24-22(15-27-29)23(25-16-26-24)28-18-10-12-21(13-11-18)30-20-8-3-2-4-9-20/h2-16H,1H3,(H,25,26,28)