1-methyl-N-[1-(phenylmethyl)piperidin-3-yl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-methyl-N-[1-(phenylmethyl)piperidin-3-yl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(1-benzyl-3-piperidyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-methyl-N-[1-(phenylmethyl)-3-piperidinyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(1-benzylpiperidin-3-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (1-benzyl-3-piperidyl)-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C18H22N6 MolecularWeight: 322.40748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)NC3CCCN(C3)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)NC3CCCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C18H22N6/c1-23-18-16(10-21-23)17(19-13-20-18)22-15-8-5-9-24(12-15)11-14-6-3-2-4-7-14/h2-4,6-7,10,13,15H,5,8-9,11-12H2,1H3,(H,19,20,22)