8-[2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-(2-oxidanyl-3-phenoxy-propyl)purine-2,6-dione

Systemtic Name: 8-[2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-(2-oxidanyl-3-phenoxy-propyl)purine-2,6-dione Openeye Name: 8-[2-[(4-ethoxyphenyl)methylene]hydrazino]-7-(2-hydroxy-3-phenoxy-propyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-[2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-[2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 8-[N'-(4-ethoxybenzylidene)hydrazino]-7-(2-hydroxy-3-phenoxy-propyl)-1,3-dimethyl-xanthine Formula: C25H28N6O5 MolecularWeight: 492.52702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=NNC2=NC3=C(N2CC(COC4=CC=CC=C4)O)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C=NNC2=NC3=C(N2CC(COC4=CC=CC=C4)O)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C25H28N6O5/c1-4-35-20-12-10-17(11-13-20)14-26-28-24-27-22-21(23(33)30(3)25(34)29(22)2)31(24)15-18(32)16-36-19-8-6-5-7-9-19/h5-14,18,32H,4,15-16H2,1-3H3,(H,27,28)