5-[[3-bromanyl-4-(diethylamino)phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[3-bromanyl-4-(diethylamino)phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[3-bromo-4-(diethylamino)phenyl]methylene]-1-cyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[3-bromo-4-(diethylamino)phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[3-bromo-4-(diethylamino)phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[3-bromo-4-(diethylamino)benzylidene]-1-cyclohexyl-barbituric acid Formula: C21H26BrN3O3 MolecularWeight: 448.35344

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)Br

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)Br

InChI

InChI=1S/C21H26BrN3O3/c1-3-24(4-2)18-11-10-14(13-17(18)22)12-16-19(26)23-21(28)25(20(16)27)15-8-6-5-7-9-15/h10-13,15H,3-9H2,1-2H3,(H,23,26,28)