1-butyl-5-[(3-imidazol-1-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-butyl-5-[(3-imidazol-1-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-butyl-5-[(3-imidazol-1-ylpropylamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-butyl-5-[[3-(1-imidazolyl)propylamino]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-butyl-5-[(3-imidazol-1-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-butyl-5-[(3-imidazol-1-ylpropylamino)methylene]barbituric acid Formula: C15H21N5O3 MolecularWeight: 319.35894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CNCCCN2C=CN=C2)C(=O)NC1=O

Isomeric SMILES

CCCCN1C(=O)C(=CNCCCN2C=CN=C2)C(=O)NC1=O

InChI

InChI=1S/C15H21N5O3/c1-2-3-8-20-14(22)12(13(21)18-15(20)23)10-16-5-4-7-19-9-6-17-11-19/h6,9-11,16H,2-5,7-8H2,1H3,(H,18,21,23)