2-[[4-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxy-phenyl]amino]propan-1-ol

Systemtic Name: 2-[[4-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxy-phenyl]amino]propan-1-ol Openeye Name: 2-[4-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxy-anilino]propan-1-ol CAS Name: 2-[4-(4-amino-1-propan-2-yl-3-pyrazolo[3,4-d]pyrimidinyl)-2-methoxyanilino]-1-propanol IUPAC Name: 2-[4-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxyanilino]propan-1-ol Traditional Name: 2-[4-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxy-anilino]propan-1-ol Formula: C18H24N6O2 MolecularWeight: 356.42216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=N1)C3=CC(=C(C=C3)NC(C)CO)OC)C(=NC=N2)N

Isomeric SMILES

CC(C)N1C2=C(C(=N1)C3=CC(=C(C=C3)NC(C)CO)OC)C(=NC=N2)N

InChI

InChI=1S/C18H24N6O2/c1-10(2)24-18-15(17(19)20-9-21-18)16(23-24)12-5-6-13(14(7-12)26-4)22-11(3)8-25/h5-7,9-11,22,25H,8H2,1-4H3,(H2,19,20,21)