3-[2-(3-aminophenyl)ethyl]-8-[(3-aminophenyl)methyl]-1-propyl-7H-purine-2,6-dione

Systemtic Name: 3-[2-(3-aminophenyl)ethyl]-8-[(3-aminophenyl)methyl]-1-propyl-7H-purine-2,6-dione Openeye Name: 3-[2-(3-aminophenyl)ethyl]-8-[(3-aminophenyl)methyl]-1-propyl-7H-purine-2,6-dione CAS Name: 3-[2-(3-aminophenyl)ethyl]-8-[(3-aminophenyl)methyl]-1-propyl-7H-purine-2,6-dione IUPAC Name: 3-[2-(3-aminophenyl)ethyl]-8-[(3-aminophenyl)methyl]-1-propyl-7H-purine-2,6-dione Traditional Name: 8-(3-aminobenzyl)-3-[2-(3-aminophenyl)ethyl]-1-propyl-7H-purine-2,6-quinone Formula: C23H26N6O2 MolecularWeight: 418.49154

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)CC3=CC(=CC=C3)N)N(C1=O)CCC4=CC(=CC=C4)N

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)CC3=CC(=CC=C3)N)N(C1=O)CCC4=CC(=CC=C4)N

InChI

InChI=1S/C23H26N6O2/c1-2-10-29-22(30)20-21(27-19(26-20)14-16-6-4-8-18(25)13-16)28(23(29)31)11-9-15-5-3-7-17(24)12-15/h3-8,12-13H,2,9-11,14,24-25H2,1H3,(H,26,27)