N-[3-(benzimidazol-1-yl)propyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[3-(1-benzimidazolyl)propyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 3-(benzimidazol-1-yl)propyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C21H19N7 MolecularWeight: 369.42246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCCN4C=NC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCCN4C=NC5=CC=CC=C54

InChI

InChI=1S/C21H19N7/c1-2-7-16(8-3-1)28-21-17(13-26-28)20(23-14-24-21)22-11-6-12-27-15-25-18-9-4-5-10-19(18)27/h1-5,7-10,13-15H,6,11-12H2,(H,22,23,24)