N-[(2-chlorophenyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[(2-chlorophenyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[(2-chlorophenyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[(2-chlorophenyl)methyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[(2-chlorophenyl)methyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (2-chlorobenzyl)-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C18H14ClN5 MolecularWeight: 335.79026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C18H14ClN5/c19-16-9-5-4-6-13(16)10-20-17-15-11-23-24(18(15)22-12-21-17)14-7-2-1-3-8-14/h1-9,11-12H,10H2,(H,20,21,22)