8-[6-[2-(4-ethanoylphenyl)-2-oxidanylidene-ethoxy]pyridazin-3-yl]-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-[6-[2-(4-ethanoylphenyl)-2-oxidanylidene-ethoxy]pyridazin-3-yl]-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-[6-[2-(4-acetylphenyl)-2-oxo-ethoxy]pyridazin-3-yl]-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-[6-[2-(4-acetylphenyl)-2-oxoethoxy]-3-pyridazinyl]-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-[6-[2-(4-acetylphenyl)-2-oxoethoxy]pyridazin-3-yl]-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-[6-[2-(4-acetylphenyl)-2-keto-ethoxy]pyridazin-3-yl]-1,3-dipropyl-7H-purine-2,6-quinone Formula: C25H26N6O5 MolecularWeight: 490.51114

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=NN=C(C=C3)OCC(=O)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=NN=C(C=C3)OCC(=O)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C25H26N6O5/c1-4-12-30-23-21(24(34)31(13-5-2)25(30)35)26-22(27-23)18-10-11-20(29-28-18)36-14-19(33)17-8-6-16(7-9-17)15(3)32/h6-11H,4-5,12-14H2,1-3H3,(H,26,27)