N-[4-[[6-[2-(4-phenylphenyl)ethylamino]-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]ethanamide

Systemtic Name: N-[4-[[6-[2-(4-phenylphenyl)ethylamino]-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]ethanamide Openeye Name: N-[4-[[9-isopropyl-6-[2-(4-phenylphenyl)ethylamino]purin-2-yl]amino]cyclohexyl]acetamide CAS Name: N-[4-[[6-[2-(4-phenylphenyl)ethylamino]-9-propan-2-yl-2-purinyl]amino]cyclohexyl]acetamide IUPAC Name: N-[4-[[6-[2-(4-phenylphenyl)ethylamino]-9-propan-2-ylpurin-2-yl]amino]cyclohexyl]acetamide Traditional Name: N-[4-[[9-isopropyl-6-[2-(4-phenylphenyl)ethylamino]purin-2-yl]amino]cyclohexyl]acetamide Formula: C30H37N7O MolecularWeight: 511.66108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)NC(=O)C

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)NC(=O)C

InChI

InChI=1S/C30H37N7O/c1-20(2)37-19-32-27-28(31-18-17-22-9-11-24(12-10-22)23-7-5-4-6-8-23)35-30(36-29(27)37)34-26-15-13-25(14-16-26)33-21(3)38/h4-12,19-20,25-26H,13-18H2,1-3H3,(H,33,38)(H2,31,34,35,36)