3-methyl-7-(2-methylpropyl)-8-[2-(1-phenylbutylidene)hydrazinyl]purine-2,6-dione

Systemtic Name: 3-methyl-7-(2-methylpropyl)-8-[2-(1-phenylbutylidene)hydrazinyl]purine-2,6-dione Openeye Name: 7-isobutyl-3-methyl-8-[2-(1-phenylbutylidene)hydrazino]purine-2,6-dione CAS Name: 3-methyl-7-(2-methylpropyl)-8-[2-(1-phenylbutylidene)hydrazinyl]purine-2,6-dione IUPAC Name: 3-methyl-7-(2-methylpropyl)-8-[2-(1-phenylbutylidene)hydrazinyl]purine-2,6-dione Traditional Name: 7-isobutyl-3-methyl-8-[N'-(1-phenylbutylidene)hydrazino]xanthine Formula: C20H26N6O2 MolecularWeight: 382.45944

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC1=NC2=C(N1CC(C)C)C(=O)NC(=O)N2C)C3=CC=CC=C3

Isomeric SMILES

CCCC(=NNC1=NC2=C(N1CC(C)C)C(=O)NC(=O)N2C)C3=CC=CC=C3

InChI

InChI=1S/C20H26N6O2/c1-5-9-15(14-10-7-6-8-11-14)23-24-19-21-17-16(26(19)12-13(2)3)18(27)22-20(28)25(17)4/h6-8,10-11,13H,5,9,12H2,1-4H3,(H,21,24)(H,22,27,28)