N-[8-(4-fluorophenyl)-2-methyl-9-propyl-purin-6-yl]-N',N'-dimethyl-propane-1,3-diamine

Systemtic Name: N-[8-(4-fluorophenyl)-2-methyl-9-propyl-purin-6-yl]-N',N'-dimethyl-propane-1,3-diamine Openeye Name: N-[8-(4-fluorophenyl)-2-methyl-9-propyl-purin-6-yl]-N',N'-dimethyl-propane-1,3-diamine CAS Name: N-[8-(4-fluorophenyl)-2-methyl-9-propyl-6-purinyl]-N',N'-dimethylpropane-1,3-diamine IUPAC Name: N-[8-(4-fluorophenyl)-2-methyl-9-propylpurin-6-yl]-N',N'-dimethylpropane-1,3-diamine Traditional Name: 3-[[8-(4-fluorophenyl)-2-methyl-9-propyl-purin-6-yl]amino]propyl-dimethyl-amine Formula: C20H27FN6 MolecularWeight: 370.466983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C)NCCCN(C)C)N=C1C3=CC=C(C=C3)F

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C)NCCCN(C)C)N=C1C3=CC=C(C=C3)F

InChI

InChI=1S/C20H27FN6/c1-5-12-27-19(15-7-9-16(21)10-8-15)25-17-18(22-11-6-13-26(3)4)23-14(2)24-20(17)27/h7-10H,5-6,11-13H2,1-4H3,(H,22,23,24)