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

Systemtic Name: 3-[[4-[(4-ethoxyphenyl)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]propan-1-ol Openeye Name: 3-[[4-(4-ethoxyanilino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]propan-1-ol CAS Name: 3-[[4-(4-ethoxyanilino)-1-phenyl-6-pyrazolo[3,4-d]pyrimidinyl]amino]-1-propanol IUPAC Name: 3-[[4-(4-ethoxyanilino)-1-phenylpyrazolo[3,4-d]pyrimidin-6-yl]amino]propan-1-ol Traditional Name: 3-[[1-phenyl-4-(p-phenetidino)pyrazolo[3,4-d]pyrimidin-6-yl]amino]propan-1-ol Formula: C22H24N6O2 MolecularWeight: 404.46496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCCCO

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCCCO

InChI

InChI=1S/C22H24N6O2/c1-2-30-18-11-9-16(10-12-18)25-20-19-15-24-28(17-7-4-3-5-8-17)21(19)27-22(26-20)23-13-6-14-29/h3-5,7-12,15,29H,2,6,13-14H2,1H3,(H2,23,25,26,27)