1,3-dicyclohexyl-5-[[2-(1H-imidazol-5-yl)ethylamino]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1,3-dicyclohexyl-5-[[2-(1H-imidazol-5-yl)ethylamino]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1,3-dicyclohexyl-5-[[2-(1H-imidazol-5-yl)ethylamino]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1,3-dicyclohexyl-5-[[2-(1H-imidazol-5-yl)ethylamino]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1,3-dicyclohexyl-5-[[2-(1H-imidazol-5-yl)ethylamino]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1,3-dicyclohexyl-5-[[2-(1H-imidazol-5-yl)ethylamino]methylene]barbituric acid Formula: C22H31N5O3 MolecularWeight: 413.51324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CNCCC3=CN=CN3)C(=O)N(C2=O)C4CCCCC4

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CNCCC3=CN=CN3)C(=O)N(C2=O)C4CCCCC4

InChI

InChI=1S/C22H31N5O3/c28-20-19(14-23-12-11-16-13-24-15-25-16)21(29)27(18-9-5-2-6-10-18)22(30)26(20)17-7-3-1-4-8-17/h13-15,17-18,23H,1-12H2,(H,24,25)