[4-[6-ethyl-3-methyl-1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[6-ethyl-3-methyl-1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[6-ethyl-3-methyl-1-(o-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[6-ethyl-3-methyl-1-(2-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[6-ethyl-3-methyl-1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[6-ethyl-3-methyl-1-(o-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazino]-phenyl-methanone Formula: C26H28N6O MolecularWeight: 440.54012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=NN2C3=CC=CC=C3C)C)C(=N1)N4CCN(CC4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CCC1=NC2=C(C(=NN2C3=CC=CC=C3C)C)C(=N1)N4CCN(CC4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H28N6O/c1-4-22-27-24(30-14-16-31(17-15-30)26(33)20-11-6-5-7-12-20)23-19(3)29-32(25(23)28-22)21-13-9-8-10-18(21)2/h5-13H,4,14-17H2,1-3H3