5-[[7-butyl-3-methyl-2,6-bis(oxidanylidene)purin-8-yl]hydrazinylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[7-butyl-3-methyl-2,6-bis(oxidanylidene)purin-8-yl]hydrazinylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(7-butyl-3-methyl-2,6-dioxo-purin-8-yl)hydrazono]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(7-butyl-3-methyl-2,6-dioxo-8-purinyl)hydrazinylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(7-butyl-3-methyl-2,6-dioxopurin-8-yl)hydrazinylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(7-butyl-2,6-diketo-3-methyl-purin-8-yl)hydrazono]barbituric acid Formula: C14H16N8O5 MolecularWeight: 376.32744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(N=C1NN=C3C(=O)NC(=O)NC3=O)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCN1C2=C(N=C1NN=C3C(=O)NC(=O)NC3=O)N(C(=O)NC2=O)C

InChI

InChI=1S/C14H16N8O5/c1-3-4-5-22-7-8(21(2)14(27)18-11(7)25)15-12(22)20-19-6-9(23)16-13(26)17-10(6)24/h3-5H2,1-2H3,(H,15,20)(H,18,25,27)(H2,16,17,23,24,26)