N2-[4-(cyclopropylmethylamino)cyclohexyl]-N6-[(4-phenylphenyl)methyl]-9-propan-2-yl-purine-2,6-diamine

Systemtic Name: N2-[4-(cyclopropylmethylamino)cyclohexyl]-N6-[(4-phenylphenyl)methyl]-9-propan-2-yl-purine-2,6-diamine Openeye Name: N2-[4-(cyclopropylmethylamino)cyclohexyl]-9-isopropyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine CAS Name: N2-[4-(cyclopropylmethylamino)cyclohexyl]-N6-[(4-phenylphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 2-N-[4-(cyclopropylmethylamino)cyclohexyl]-6-N-[(4-phenylphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine Traditional Name: cyclopropylmethyl-[4-[[9-isopropyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amino]cyclohexyl]amine Formula: C31H39N7 MolecularWeight: 509.68826

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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)NC5CCC(CC5)NCC6CC6

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)NCC6CC6

InChI

InChI=1S/C31H39N7/c1-21(2)38-20-34-28-29(33-19-23-10-12-25(13-11-23)24-6-4-3-5-7-24)36-31(37-30(28)38)35-27-16-14-26(15-17-27)32-18-22-8-9-22/h3-7,10-13,20-22,26-27,32H,8-9,14-19H2,1-2H3,(H2,33,35,36,37)