1,3-dimethyl-7-(2-oxidanyl-3-phenoxy-propyl)-8-[2-(phenylmethylidene)hydrazinyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-(2-oxidanyl-3-phenoxy-propyl)-8-[2-(phenylmethylidene)hydrazinyl]purine-2,6-dione Openeye Name: 8-(2-benzylidenehydrazino)-7-(2-hydroxy-3-phenoxy-propyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[2-(phenylmethylene)hydrazinyl]purine-2,6-dione IUPAC Name: 8-(2-benzylidenehydrazinyl)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 8-(N'-benzalhydrazino)-7-(2-hydroxy-3-phenoxy-propyl)-1,3-dimethyl-xanthine Formula: C23H24N6O4 MolecularWeight: 448.47446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN=CC3=CC=CC=C3)CC(COC4=CC=CC=C4)O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN=CC3=CC=CC=C3)CC(COC4=CC=CC=C4)O

InChI

InChI=1S/C23H24N6O4/c1-27-20-19(21(31)28(2)23(27)32)29(14-17(30)15-33-18-11-7-4-8-12-18)22(25-20)26-24-13-16-9-5-3-6-10-16/h3-13,17,30H,14-15H2,1-2H3,(H,25,26)