8-[5-(2-chlorophenyl)furan-2-yl]-7-methyl-3-(phenylmethyl)purine-2,6-dione

Systemtic Name: 8-[5-(2-chlorophenyl)furan-2-yl]-7-methyl-3-(phenylmethyl)purine-2,6-dione Openeye Name: 3-benzyl-8-[5-(2-chlorophenyl)-2-furyl]-7-methyl-purine-2,6-dione CAS Name: 8-[5-(2-chlorophenyl)-2-furanyl]-7-methyl-3-(phenylmethyl)purine-2,6-dione IUPAC Name: 3-benzyl-8-[5-(2-chlorophenyl)furan-2-yl]-7-methylpurine-2,6-dione Traditional Name: 3-benzyl-8-[5-(2-chlorophenyl)-2-furyl]-7-methyl-xanthine Formula: C23H17ClN4O3 MolecularWeight: 432.85908

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1C3=CC=C(O3)C4=CC=CC=C4Cl)N(C(=O)NC2=O)CC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(N=C1C3=CC=C(O3)C4=CC=CC=C4Cl)N(C(=O)NC2=O)CC5=CC=CC=C5

InChI

InChI=1S/C23H17ClN4O3/c1-27-19-21(28(23(30)26-22(19)29)13-14-7-3-2-4-8-14)25-20(27)18-12-11-17(31-18)15-9-5-6-10-16(15)24/h2-12H,13H2,1H3,(H,26,29,30)