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

Systemtic Name: 7-hexyl-3-methyl-8-[(2Z)-2-(phenylmethylidene)hydrazinyl]purine-2,6-dione Openeye Name: 8-[(2Z)-2-benzylidenehydrazino]-7-hexyl-3-methyl-purine-2,6-dione CAS Name: 7-hexyl-3-methyl-8-[(2Z)-2-(phenylmethylene)hydrazinyl]purine-2,6-dione IUPAC Name: 8-[(2Z)-2-benzylidenehydrazinyl]-7-hexyl-3-methylpurine-2,6-dione Traditional Name: 8-[(N'Z)-N'-benzalhydrazino]-7-hexyl-3-methyl-xanthine Formula: C19H24N6O2 MolecularWeight: 368.43286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(N=C1NN=CC3=CC=CC=C3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCN1C2=C(N=C1N/N=C\C3=CC=CC=C3)N(C(=O)NC2=O)C

InChI

InChI=1S/C19H24N6O2/c1-3-4-5-9-12-25-15-16(24(2)19(27)22-17(15)26)21-18(25)23-20-13-14-10-7-6-8-11-14/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,21,23)(H,22,26,27)/b20-13-