3-[3-[(2,6-dimethylphenyl)amino]-6-phenylazanyl-pyrazolo[3,4-d]pyrimidin-1-yl]propan-1-ol

Systemtic Name: 3-[3-[(2,6-dimethylphenyl)amino]-6-phenylazanyl-pyrazolo[3,4-d]pyrimidin-1-yl]propan-1-ol Openeye Name: 3-[6-anilino-3-(2,6-dimethylanilino)pyrazolo[3,4-d]pyrimidin-1-yl]propan-1-ol CAS Name: 3-[6-anilino-3-(2,6-dimethylanilino)-1-pyrazolo[3,4-d]pyrimidinyl]-1-propanol IUPAC Name: 3-[6-anilino-3-(2,6-dimethylanilino)pyrazolo[3,4-d]pyrimidin-1-yl]propan-1-ol Traditional Name: 3-[6-anilino-3-(2,6-dimethylanilino)pyrazolo[3,4-d]pyrimidin-1-yl]propan-1-ol Formula: C22H24N6O MolecularWeight: 388.46556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NN(C3=NC(=NC=C23)NC4=CC=CC=C4)CCCO

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NN(C3=NC(=NC=C23)NC4=CC=CC=C4)CCCO

InChI

InChI=1S/C22H24N6O/c1-15-8-6-9-16(2)19(15)25-20-18-14-23-22(24-17-10-4-3-5-11-17)26-21(18)28(27-20)12-7-13-29/h3-6,8-11,14,29H,7,12-13H2,1-2H3,(H,25,27)(H,23,24,26)