1-(phenylmethyl)-N-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(phenylmethyl)-N-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-benzyl-N-(3-pyridylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(phenylmethyl)-N-(3-pyridinylmethyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-benzyl-N-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)-(3-pyridylmethyl)amine Formula: C18H16N6 MolecularWeight: 316.35984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)NCC4=CN=CC=C4

InChI

InChI=1S/C18H16N6/c1-2-5-14(6-3-1)12-24-18-16(11-23-24)17(21-13-22-18)20-10-15-7-4-8-19-9-15/h1-9,11,13H,10,12H2,(H,20,21,22)