2-[2-hydroxyethyl-[1-methyl-4-[(phenylmethyl)amino]pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol

Systemtic Name: 2-[2-hydroxyethyl-[1-methyl-4-[(phenylmethyl)amino]pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Openeye Name: 2-[[4-(benzylamino)-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol CAS Name: 2-[2-hydroxyethyl-[1-methyl-4-[(phenylmethyl)amino]-6-pyrazolo[3,4-d]pyrimidinyl]amino]ethanol IUPAC Name: 2-[[4-(benzylamino)-1-methylpyrazolo[3,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol Traditional Name: 2-[[4-(benzylamino)-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol Formula: C17H22N6O2 MolecularWeight: 342.39558

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)N(CCO)CCO)NCC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)N(CCO)CCO)NCC3=CC=CC=C3

InChI

InChI=1S/C17H22N6O2/c1-22-16-14(12-19-22)15(18-11-13-5-3-2-4-6-13)20-17(21-16)23(7-9-24)8-10-25/h2-6,12,24-25H,7-11H2,1H3,(H,18,20,21)