7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(phenylmethylidene)hydrazinyl]purine-2,6-dione

Systemtic Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(phenylmethylidene)hydrazinyl]purine-2,6-dione Openeye Name: 8-[(2E)-2-benzylidenehydrazino]-7-(2-hydroxyethyl)-3-methyl-purine-2,6-dione CAS Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(phenylmethylene)hydrazinyl]purine-2,6-dione IUPAC Name: 8-[(2E)-2-benzylidenehydrazinyl]-7-(2-hydroxyethyl)-3-methylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-benzalhydrazino]-7-(2-hydroxyethyl)-3-methyl-xanthine Formula: C15H16N6O3 MolecularWeight: 328.32594

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC=CC=C3)CCO

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N/N=C/C3=CC=CC=C3)CCO

InChI

InChI=1S/C15H16N6O3/c1-20-12-11(13(23)18-15(20)24)21(7-8-22)14(17-12)19-16-9-10-5-3-2-4-6-10/h2-6,9,22H,7-8H2,1H3,(H,17,19)(H,18,23,24)/b16-9+