1-(4-chlorophenyl)-8-[(2-hydroxyethylamino)methyl]-9-phenyl-2-(4-phenylphenyl)purin-6-one

Systemtic Name: 1-(4-chlorophenyl)-8-[(2-hydroxyethylamino)methyl]-9-phenyl-2-(4-phenylphenyl)purin-6-one Openeye Name: 1-(4-chlorophenyl)-8-[(2-hydroxyethylamino)methyl]-9-phenyl-2-(4-phenylphenyl)purin-6-one CAS Name: 1-(4-chlorophenyl)-8-[(2-hydroxyethylamino)methyl]-9-phenyl-2-(4-phenylphenyl)-6-purinone IUPAC Name: 1-(4-chlorophenyl)-8-[(2-hydroxyethylamino)methyl]-9-phenyl-2-(4-phenylphenyl)purin-6-one Traditional Name: 1-(4-chlorophenyl)-8-[(2-hydroxyethylamino)methyl]-9-phenyl-2-(4-phenylphenyl)purin-6-one Formula: C32H26ClN5O2 MolecularWeight: 548.03414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC4=C(C(=O)N3C5=CC=C(C=C5)Cl)N=C(N4C6=CC=CC=C6)CNCCO

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC4=C(C(=O)N3C5=CC=C(C=C5)Cl)N=C(N4C6=CC=CC=C6)CNCCO

InChI

InChI=1S/C32H26ClN5O2/c33-25-15-17-27(18-16-25)38-30(24-13-11-23(12-14-24)22-7-3-1-4-8-22)36-31-29(32(38)40)35-28(21-34-19-20-39)37(31)26-9-5-2-6-10-26/h1-18,34,39H,19-21H2