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

Systemtic Name: 3-[[4-[(4-methoxyphenyl)amino]-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]propan-1-ol Openeye Name: 3-[[4-(4-methoxyanilino)-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]propan-1-ol CAS Name: 3-[[4-(4-methoxyanilino)-1-methyl-6-pyrazolo[3,4-d]pyrimidinyl]amino]-1-propanol IUPAC Name: 3-[[4-(4-methoxyanilino)-1-methylpyrazolo[3,4-d]pyrimidin-6-yl]amino]propan-1-ol Traditional Name: 3-[[1-methyl-4-(p-anisidino)pyrazolo[3,4-d]pyrimidin-6-yl]amino]propan-1-ol Formula: C16H20N6O2 MolecularWeight: 328.369

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)NCCCO)NC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)NCCCO)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C16H20N6O2/c1-22-15-13(10-18-22)14(20-16(21-15)17-8-3-9-23)19-11-4-6-12(24-2)7-5-11/h4-7,10,23H,3,8-9H2,1-2H3,(H2,17,19,20,21)