3-[[1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]propan-1-ol

Systemtic Name: 3-[[1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]propan-1-ol Openeye Name: 3-[[1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]propan-1-ol CAS Name: 3-[[1-methyl-6-(4-phenyl-1-piperazinyl)-4-pyrazolo[3,4-d]pyrimidinyl]amino]-1-propanol IUPAC Name: 3-[[1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]propan-1-ol Traditional Name: 3-[[1-methyl-6-(4-phenylpiperazino)pyrazolo[3,4-d]pyrimidin-4-yl]amino]propan-1-ol Formula: C19H25N7O MolecularWeight: 367.4481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C4=CC=CC=C4)NCCCO

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C4=CC=CC=C4)NCCCO

InChI

InChI=1S/C19H25N7O/c1-24-18-16(14-21-24)17(20-8-5-13-27)22-19(23-18)26-11-9-25(10-12-26)15-6-3-2-4-7-15/h2-4,6-7,14,27H,5,8-13H2,1H3,(H,20,22,23)