9-cyclohexyl-2-[(2,2-dimethyl-3H-1-benzofuran-6-yl)oxy]-N-(4-morpholin-4-ylphenyl)purin-6-amine

Systemtic Name: 9-cyclohexyl-2-[(2,2-dimethyl-3H-1-benzofuran-6-yl)oxy]-N-(4-morpholin-4-ylphenyl)purin-6-amine Openeye Name: 9-cyclohexyl-2-[(2,2-dimethyl-3H-benzofuran-6-yl)oxy]-N-(4-morpholinophenyl)purin-6-amine CAS Name: 9-cyclohexyl-2-[(2,2-dimethyl-3H-benzofuran-6-yl)oxy]-N-[4-(4-morpholinyl)phenyl]-6-purinamine IUPAC Name: 9-cyclohexyl-2-[(2,2-dimethyl-3H-1-benzofuran-6-yl)oxy]-N-(4-morpholin-4-ylphenyl)purin-6-amine Traditional Name: [9-cyclohexyl-2-(2,2-dimethylcoumaran-6-yl)oxy-purin-6-yl]-(4-morpholinophenyl)amine Formula: C31H36N6O3 MolecularWeight: 540.65594

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C=C(C=C2)OC3=NC4=C(C(=N3)NC5=CC=C(C=C5)N6CCOCC6)N=CN4C7CCCCC7)C

Isomeric SMILES

CC1(CC2=C(O1)C=C(C=C2)OC3=NC4=C(C(=N3)NC5=CC=C(C=C5)N6CCOCC6)N=CN4C7CCCCC7)C

InChI

InChI=1S/C31H36N6O3/c1-31(2)19-21-8-13-25(18-26(21)40-31)39-30-34-28(27-29(35-30)37(20-32-27)24-6-4-3-5-7-24)33-22-9-11-23(12-10-22)36-14-16-38-17-15-36/h8-13,18,20,24H,3-7,14-17,19H2,1-2H3,(H,33,34,35)