1-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]naphthalen-2-ol

Systemtic Name: 1-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]naphthalen-2-ol Openeye Name: 1-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]naphthalen-2-ol CAS Name: 1-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]-2-naphthalenol IUPAC Name: 1-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]naphthalen-2-ol Traditional Name: 1-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]-2-naphthol Formula: C21H22N6O MolecularWeight: 374.43898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=C(C=CC5=CC=CC=C54)O

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=C(C=CC5=CC=CC=C54)O

InChI

InChI=1S/C21H22N6O/c1-25-20-17(12-24-25)21(23-14-22-20)27-10-8-26(9-11-27)13-18-16-5-3-2-4-15(16)6-7-19(18)28/h2-7,12,14,28H,8-11,13H2,1H3