N-[3-(dimethylaminomethyl)phenyl]-9-ethyl-8-pyridin-4-yl-purin-2-amine

Systemtic Name: N-[3-(dimethylaminomethyl)phenyl]-9-ethyl-8-pyridin-4-yl-purin-2-amine Openeye Name: N-[3-(dimethylaminomethyl)phenyl]-9-ethyl-8-(4-pyridyl)purin-2-amine CAS Name: N-[3-(dimethylaminomethyl)phenyl]-9-ethyl-8-pyridin-4-yl-2-purinamine IUPAC Name: N-[3-(dimethylaminomethyl)phenyl]-9-ethyl-8-pyridin-4-ylpurin-2-amine Traditional Name: [3-[[9-ethyl-8-(4-pyridyl)purin-2-yl]amino]benzyl]-dimethyl-amine Formula: C21H23N7 MolecularWeight: 373.45422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=CN=C(N=C21)NC3=CC=CC(=C3)CN(C)C)C4=CC=NC=C4

Isomeric SMILES

CCN1C(=NC2=CN=C(N=C21)NC3=CC=CC(=C3)CN(C)C)C4=CC=NC=C4

InChI

InChI=1S/C21H23N7/c1-4-28-19(16-8-10-22-11-9-16)25-18-13-23-21(26-20(18)28)24-17-7-5-6-15(12-17)14-27(2)3/h5-13H,4,14H2,1-3H3,(H,23,24,26)