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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C(N(C(=O)N3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C(N(C(=O)N3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H22N4O/c30-25-27-24-23(28(18-26-24)16-19-10-4-1-5-11-19)22(21-14-8-3-9-15-21)29(25)17-20-12-6-2-7-13-20/h1-15,18,22H,16-17H2,(H,27,30)