5-[(2-methylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(2-methylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(isobutylamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(2-methylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2-methylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(isobutylamino)methylene]barbituric acid Formula: C9H13N3O3 MolecularWeight: 211.21782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC=C1C(=O)NC(=O)NC1=O

Isomeric SMILES

CC(C)CNC=C1C(=O)NC(=O)NC1=O

InChI

InChI=1S/C9H13N3O3/c1-5(2)3-10-4-6-7(13)11-9(15)12-8(6)14/h4-5,10H,3H2,1-2H3,(H2,11,12,13,14,15)