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

Systemtic Name: N2-[2-(dipropylamino)ethyl]-N6-[(4-phenylphenyl)methyl]-9-propan-2-yl-purine-2,6-diamine Openeye Name: N2-[2-(dipropylamino)ethyl]-9-isopropyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine CAS Name: N2-[2-(dipropylamino)ethyl]-N6-[(4-phenylphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 2-N-[2-(dipropylamino)ethyl]-6-N-[(4-phenylphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine Traditional Name: 2-[[9-isopropyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amino]ethyl-dipropyl-amine Formula: C29H39N7 MolecularWeight: 485.66686

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCNC1=NC2=C(C(=N1)NCC3=CC=C(C=C3)C4=CC=CC=C4)N=CN2C(C)C

Isomeric SMILES

CCCN(CCC)CCNC1=NC2=C(C(=N1)NCC3=CC=C(C=C3)C4=CC=CC=C4)N=CN2C(C)C

InChI

InChI=1S/C29H39N7/c1-5-17-35(18-6-2)19-16-30-29-33-27(26-28(34-29)36(21-32-26)22(3)4)31-20-23-12-14-25(15-13-23)24-10-8-7-9-11-24/h7-15,21-22H,5-6,16-20H2,1-4H3,(H2,30,31,33,34)