1-phenyl-3-[2-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]urea

Systemtic Name: 1-phenyl-3-[2-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]urea Openeye Name: 1-[2-[[9-isopropyl-6-[(4-phenylphenyl)methylamino]purin-2-yl]amino]cyclohexyl]-3-phenyl-urea CAS Name: 1-phenyl-3-[2-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]cyclohexyl]urea IUPAC Name: 1-phenyl-3-[2-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]cyclohexyl]urea Traditional Name: 1-[2-[[9-isopropyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amino]cyclohexyl]-3-phenyl-urea Formula: C34H38N8O MolecularWeight: 574.71852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCCCC5NC(=O)NC6=CC=CC=C6

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCCCC5NC(=O)NC6=CC=CC=C6

InChI

InChI=1S/C34H38N8O/c1-23(2)42-22-36-30-31(35-21-24-17-19-26(20-18-24)25-11-5-3-6-12-25)40-33(41-32(30)42)38-28-15-9-10-16-29(28)39-34(43)37-27-13-7-4-8-14-27/h3-8,11-14,17-20,22-23,28-29H,9-10,15-16,21H2,1-2H3,(H2,37,39,43)(H2,35,38,40,41)