5-(butyliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(butyliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(butyliminomethyl)-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(butyliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(butyliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(butyliminomethyl)-1-phenyl-barbituric acid Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=CC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCN=CC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C15H17N3O3/c1-2-3-9-16-10-12-13(19)17-15(21)18(14(12)20)11-7-5-4-6-8-11/h4-8,10,12H,2-3,9H2,1H3,(H,17,19,21)