1-cyclopentyl-3-[4-(naphthalen-2-ylmethyl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-cyclopentyl-3-[4-(naphthalen-2-ylmethyl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-cyclopentyl-3-[4-(2-naphthylmethyl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-cyclopentyl-3-[4-(2-naphthalenylmethyl)phenyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-cyclopentyl-3-[4-(naphthalen-2-ylmethyl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-cyclopentyl-3-[4-(2-naphthylmethyl)phenyl]pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C27H25N5 MolecularWeight: 419.5209

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C(=N2)C4=CC=C(C=C4)CC5=CC6=CC=CC=C6C=C5)C(=NC=N3)N

Isomeric SMILES

C1CCC(C1)N2C3=C(C(=N2)C4=CC=C(C=C4)CC5=CC6=CC=CC=C6C=C5)C(=NC=N3)N

InChI

InChI=1S/C27H25N5/c28-26-24-25(31-32(23-7-3-4-8-23)27(24)30-17-29-26)21-13-9-18(10-14-21)15-19-11-12-20-5-1-2-6-22(20)16-19/h1-2,5-6,9-14,16-17,23H,3-4,7-8,15H2,(H2,28,29,30)