9-methyl-N-[4-(2-piperidin-1-ylethyl)phenyl]-8-pyridin-4-yl-purin-2-amine

Systemtic Name: 9-methyl-N-[4-(2-piperidin-1-ylethyl)phenyl]-8-pyridin-4-yl-purin-2-amine Openeye Name: 9-methyl-N-[4-[2-(1-piperidyl)ethyl]phenyl]-8-(4-pyridyl)purin-2-amine CAS Name: 9-methyl-N-[4-[2-(1-piperidinyl)ethyl]phenyl]-8-pyridin-4-yl-2-purinamine IUPAC Name: 9-methyl-N-[4-(2-piperidin-1-ylethyl)phenyl]-8-pyridin-4-ylpurin-2-amine Traditional Name: [9-methyl-8-(4-pyridyl)purin-2-yl]-[4-(2-piperidinoethyl)phenyl]amine Formula: C24H27N7 MolecularWeight: 413.51808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CN=C(N=C21)NC3=CC=C(C=C3)CCN4CCCCC4)C5=CC=NC=C5

Isomeric SMILES

CN1C(=NC2=CN=C(N=C21)NC3=CC=C(C=C3)CCN4CCCCC4)C5=CC=NC=C5

InChI

InChI=1S/C24H27N7/c1-30-22(19-9-12-25-13-10-19)28-21-17-26-24(29-23(21)30)27-20-7-5-18(6-8-20)11-16-31-14-3-2-4-15-31/h5-10,12-13,17H,2-4,11,14-16H2,1H3,(H,26,27,29)