8-ethyl-6-phenyl-1,7-bis(phenylmethyl)purin-2-one

Systemtic Name: 8-ethyl-6-phenyl-1,7-bis(phenylmethyl)purin-2-one Openeye Name: 1,7-dibenzyl-8-ethyl-6-phenyl-purin-2-one CAS Name: 8-ethyl-6-phenyl-1,7-bis(phenylmethyl)-2-purinone IUPAC Name: 1,7-dibenzyl-8-ethyl-6-phenylpurin-2-one Traditional Name: 1,7-dibenzyl-8-ethyl-6-phenyl-purin-2-one Formula: C27H24N4O MolecularWeight: 420.50566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=NC(=O)N(C(=C2N1CC3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CCC1=NC2=NC(=O)N(C(=C2N1CC3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H24N4O/c1-2-23-28-26-25(30(23)18-20-12-6-3-7-13-20)24(22-16-10-5-11-17-22)31(27(32)29-26)19-21-14-8-4-9-15-21/h3-17H,2,18-19H2,1H3