N-[2-[[2,6-bis(oxidanylidene)-3-phenethyl-1-propyl-7H-purin-8-yl]methyl]phenyl]ethanamide

Systemtic Name: N-[2-[[2,6-bis(oxidanylidene)-3-phenethyl-1-propyl-7H-purin-8-yl]methyl]phenyl]ethanamide Openeye Name: N-[2-[(2,6-dioxo-3-phenethyl-1-propyl-7H-purin-8-yl)methyl]phenyl]acetamide CAS Name: N-[2-[(2,6-dioxo-3-phenethyl-1-propyl-7H-purin-8-yl)methyl]phenyl]acetamide IUPAC Name: N-[2-[(2,6-dioxo-3-phenethyl-1-propyl-7H-purin-8-yl)methyl]phenyl]acetamide Traditional Name: N-[2-[(2,6-diketo-3-phenethyl-1-propyl-7H-purin-8-yl)methyl]phenyl]acetamide Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)CC3=CC=CC=C3NC(=O)C)N(C1=O)CCC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)CC3=CC=CC=C3NC(=O)C)N(C1=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O3/c1-3-14-30-24(32)22-23(29(25(30)33)15-13-18-9-5-4-6-10-18)28-21(27-22)16-19-11-7-8-12-20(19)26-17(2)31/h4-12H,3,13-16H2,1-2H3,(H,26,31)(H,27,28)