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

Systemtic Name: 3-[2-(3-aminophenyl)ethyl]-1-(3-methoxypropyl)-8-(phenylmethyl)-7H-purine-2,6-dione Openeye Name: 3-[2-(3-aminophenyl)ethyl]-8-benzyl-1-(3-methoxypropyl)-7H-purine-2,6-dione CAS Name: 3-[2-(3-aminophenyl)ethyl]-1-(3-methoxypropyl)-8-(phenylmethyl)-7H-purine-2,6-dione IUPAC Name: 3-[2-(3-aminophenyl)ethyl]-8-benzyl-1-(3-methoxypropyl)-7H-purine-2,6-dione Traditional Name: 3-[2-(3-aminophenyl)ethyl]-8-benzyl-1-(3-methoxypropyl)-7H-purine-2,6-quinone Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(N=C(N2)CC3=CC=CC=C3)N(C1=O)CCC4=CC(=CC=C4)N

Isomeric SMILES

COCCCN1C(=O)C2=C(N=C(N2)CC3=CC=CC=C3)N(C1=O)CCC4=CC(=CC=C4)N

InChI

InChI=1S/C24H27N5O3/c1-32-14-6-12-29-23(30)21-22(27-20(26-21)16-17-7-3-2-4-8-17)28(24(29)31)13-11-18-9-5-10-19(25)15-18/h2-5,7-10,15H,6,11-14,16,25H2,1H3,(H,26,27)