6-phenyl-1,3-bis(phenylmethyl)-6,7-dihydropurin-2-one

Systemtic Name: 6-phenyl-1,3-bis(phenylmethyl)-6,7-dihydropurin-2-one Openeye Name: 1,3-dibenzyl-6-phenyl-6,7-dihydropurin-2-one CAS Name: 6-phenyl-1,3-bis(phenylmethyl)-6,7-dihydropurin-2-one IUPAC Name: 1,3-dibenzyl-6-phenyl-6,7-dihydropurin-2-one Traditional Name: 1,3-dibenzyl-6-phenyl-6,7-dihydropurin-2-one Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(C3=C(N=CN3)N(C2=O)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(C3=C(N=CN3)N(C2=O)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H22N4O/c30-25-28(16-19-10-4-1-5-11-19)23(21-14-8-3-9-15-21)22-24(27-18-26-22)29(25)17-20-12-6-2-7-13-20/h1-15,18,23H,16-17H2,(H,26,27)