3-methyl-8-[(2E)-2-[(4-phenylmethoxyphenyl)methylidene]hydrazinyl]-7-propyl-purine-2,6-dione

Systemtic Name: 3-methyl-8-[(2E)-2-[(4-phenylmethoxyphenyl)methylidene]hydrazinyl]-7-propyl-purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-benzyloxyphenyl)methylene]hydrazino]-3-methyl-7-propyl-purine-2,6-dione CAS Name: 3-methyl-8-[(2E)-2-[(4-phenylmethoxyphenyl)methylidene]hydrazinyl]-7-propylpurine-2,6-dione IUPAC Name: 3-methyl-8-[(2E)-2-[(4-phenylmethoxyphenyl)methylidene]hydrazinyl]-7-propylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-(4-benzoxybenzylidene)hydrazino]-3-methyl-7-propyl-xanthine Formula: C23H24N6O3 MolecularWeight: 432.47506

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N=C1NN=CC3=CC=C(C=C3)OCC4=CC=CC=C4)N(C(=O)NC2=O)C

Isomeric SMILES

CCCN1C2=C(N=C1N/N=C/C3=CC=C(C=C3)OCC4=CC=CC=C4)N(C(=O)NC2=O)C

InChI

InChI=1S/C23H24N6O3/c1-3-13-29-19-20(28(2)23(31)26-21(19)30)25-22(29)27-24-14-16-9-11-18(12-10-16)32-15-17-7-5-4-6-8-17/h4-12,14H,3,13,15H2,1-2H3,(H,25,27)(H,26,30,31)/b24-14+