5-[[[(1R,2R)-2-azanylcyclohexyl]amino]methylidene]-1-hexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[[(1R,2R)-2-azanylcyclohexyl]amino]methylidene]-1-hexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[[(1R,2R)-2-aminocyclohexyl]amino]methylene]-1-hexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[[(1R,2R)-2-aminocyclohexyl]amino]methylidene]-1-hexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[[(1R,2R)-2-aminocyclohexyl]amino]methylidene]-1-hexyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[[(1R,2R)-2-aminocyclohexyl]amino]methylene]-1-hexyl-barbituric acid Formula: C17H28N4O3 MolecularWeight: 336.42922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(=CNC2CCCCC2N)C(=O)NC1=O

Isomeric SMILES

CCCCCCN1C(=O)C(=CN[C@@H]2CCCC[C@H]2N)C(=O)NC1=O

InChI

InChI=1S/C17H28N4O3/c1-2-3-4-7-10-21-16(23)12(15(22)20-17(21)24)11-19-14-9-6-5-8-13(14)18/h11,13-14,19H,2-10,18H2,1H3,(H,20,22,24)/t13-,14-/m1/s1