3-(4-methoxyphenyl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-methoxyphenyl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4-methoxyphenyl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one CAS Name: 3-(4-methoxyphenyl)-1-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-methoxyphenyl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 3-(4-methoxyphenyl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]propan-1-one Formula: C20H24N6O2 MolecularWeight: 380.44356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)CCC4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)CCC4=CC=C(C=C4)OC

InChI

InChI=1S/C20H24N6O2/c1-24-19-17(13-23-24)20(22-14-21-19)26-11-9-25(10-12-26)18(27)8-5-15-3-6-16(28-2)7-4-15/h3-4,6-7,13-14H,5,8-12H2,1-2H3