3-(furan-2-ylmethyl)-7-methyl-1-phenyl-8-(phenylmethyl)purine-2,6-dione

Systemtic Name: 3-(furan-2-ylmethyl)-7-methyl-1-phenyl-8-(phenylmethyl)purine-2,6-dione Openeye Name: 8-benzyl-3-(2-furylmethyl)-7-methyl-1-phenyl-purine-2,6-dione CAS Name: 3-(2-furanylmethyl)-7-methyl-1-phenyl-8-(phenylmethyl)purine-2,6-dione IUPAC Name: 8-benzyl-3-(furan-2-ylmethyl)-7-methyl-1-phenylpurine-2,6-dione Traditional Name: 8-benzyl-3-(2-furfuryl)-7-methyl-1-phenyl-xanthine Formula: C24H20N4O3 MolecularWeight: 412.4406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C1C(=O)N(C(=O)N2CC3=CC=CO3)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CN1C(=NC2=C1C(=O)N(C(=O)N2CC3=CC=CO3)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C24H20N4O3/c1-26-20(15-17-9-4-2-5-10-17)25-22-21(26)23(29)28(18-11-6-3-7-12-18)24(30)27(22)16-19-13-8-14-31-19/h2-14H,15-16H2,1H3