6-(azepan-1-yl)-4-(4-propan-2-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-3-amine

Systemtic Name: 6-(azepan-1-yl)-4-(4-propan-2-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-3-amine Openeye Name: 6-(azepan-1-yl)-4-(4-isopropylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-3-amine CAS Name: 6-(1-azepanyl)-4-(4-propan-2-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-3-amine IUPAC Name: 6-(azepan-1-yl)-4-(4-propan-2-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-3-amine Traditional Name: [6-(azepan-1-yl)-4-p-cumenyl-2H-pyrazolo[3,4-d]pyrimidin-3-yl]amine Formula: C20H26N6 MolecularWeight: 350.46064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=NNC(=C23)N)N4CCCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=NNC(=C23)N)N4CCCCCC4

InChI

InChI=1S/C20H26N6/c1-13(2)14-7-9-15(10-8-14)17-16-18(21)24-25-19(16)23-20(22-17)26-11-5-3-4-6-12-26/h7-10,13H,3-6,11-12H2,1-2H3,(H3,21,22,23,24,25)