2-[[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-1-phenyl-ethanone

Systemtic Name: 2-[[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-1-phenyl-ethanone Openeye Name: 1-phenyl-2-[[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanone CAS Name: 2-[[1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]amino]-1-phenylethanone IUPAC Name: 2-[[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-1-phenylethanone Traditional Name: 1-phenyl-2-[[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanone Formula: C20H17N5O MolecularWeight: 343.38188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N5O/c1-14-7-9-16(10-8-14)25-20-17(11-24-25)19(22-13-23-20)21-12-18(26)15-5-3-2-4-6-15/h2-11,13H,12H2,1H3,(H,21,22,23)