N,8-bis(3,4-dimethoxyphenyl)-9-(4-methoxyphenyl)purin-6-amine

Systemtic Name: N,8-bis(3,4-dimethoxyphenyl)-9-(4-methoxyphenyl)purin-6-amine Openeye Name: N,8-bis(3,4-dimethoxyphenyl)-9-(4-methoxyphenyl)purin-6-amine CAS Name: N,8-bis(3,4-dimethoxyphenyl)-9-(4-methoxyphenyl)-6-purinamine IUPAC Name: N,8-bis(3,4-dimethoxyphenyl)-9-(4-methoxyphenyl)purin-6-amine Traditional Name: (3,4-dimethoxyphenyl)-[8-(3,4-dimethoxyphenyl)-9-(4-methoxyphenyl)purin-6-yl]amine Formula: C28H27N5O5 MolecularWeight: 513.54448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=C(C(=NC=N3)NC4=CC(=C(C=C4)OC)OC)N=C2C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=C(C(=NC=N3)NC4=CC(=C(C=C4)OC)OC)N=C2C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C28H27N5O5/c1-34-20-10-8-19(9-11-20)33-27(17-6-12-21(35-2)23(14-17)37-4)32-25-26(29-16-30-28(25)33)31-18-7-13-22(36-3)24(15-18)38-5/h6-16H,1-5H3,(H,29,30,31)