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

Systemtic Name: 1-[4-(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-(6-ethyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-(6-ethyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-3-methyl-butan-1-one Formula: C22H28N6O MolecularWeight: 392.49732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N6O/c1-4-19-24-21(27-12-10-26(11-13-27)20(29)14-16(2)3)18-15-23-28(22(18)25-19)17-8-6-5-7-9-17/h5-9,15-16H,4,10-14H2,1-3H3