1-[4-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[4-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]pyrrolidine-2,5-dione Openeye Name: 1-[4-[[9-isopropyl-6-[(4-phenylphenyl)methylamino]purin-2-yl]amino]cyclohexyl]pyrrolidine-2,5-dione CAS Name: 1-[4-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]cyclohexyl]pyrrolidine-2,5-dione IUPAC Name: 1-[4-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]cyclohexyl]pyrrolidine-2,5-dione Traditional Name: 1-[4-[[9-isopropyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amino]cyclohexyl]pyrrolidine-2,5-quinone Formula: C31H35N7O2 MolecularWeight: 537.6553

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)N6C(=O)CCC6=O

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)N6C(=O)CCC6=O

InChI

InChI=1S/C31H35N7O2/c1-20(2)37-19-33-28-29(32-18-21-8-10-23(11-9-21)22-6-4-3-5-7-22)35-31(36-30(28)37)34-24-12-14-25(15-13-24)38-26(39)16-17-27(38)40/h3-11,19-20,24-25H,12-18H2,1-2H3,(H2,32,34,35,36)