1-[4-[6-ethyl-3-methyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-[6-ethyl-3-methyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[6-ethyl-3-methyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[6-ethyl-3-methyl-1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-[6-ethyl-3-methyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]propan-1-one Traditional Name: 1-[4-[6-ethyl-3-methyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazino]propan-1-one Formula: C22H28N6O MolecularWeight: 392.49732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=NN2C3=CC=C(C=C3)C)C)C(=N1)N4CCN(CC4)C(=O)CC

Isomeric SMILES

CCC1=NC2=C(C(=NN2C3=CC=C(C=C3)C)C)C(=N1)N4CCN(CC4)C(=O)CC

InChI

InChI=1S/C22H28N6O/c1-5-18-23-21(27-13-11-26(12-14-27)19(29)6-2)20-16(4)25-28(22(20)24-18)17-9-7-15(3)8-10-17/h7-10H,5-6,11-14H2,1-4H3