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

Systemtic Name: 5-[(2-bromanyl-5-ethoxy-4-propoxy-phenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(2-bromo-5-ethoxy-4-propoxy-phenyl)methylene]-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(2-bromo-5-ethoxy-4-propoxyphenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2-bromo-5-ethoxy-4-propoxyphenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(2-bromo-5-ethoxy-4-propoxy-benzylidene)-1-phenyl-barbituric acid Formula: C22H21BrN2O5 MolecularWeight: 473.31654

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)Br)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3)OCC

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)Br)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3)OCC

InChI

InChI=1S/C22H21BrN2O5/c1-3-10-30-19-13-17(23)14(12-18(19)29-4-2)11-16-20(26)24-22(28)25(21(16)27)15-8-6-5-7-9-15/h5-9,11-13H,3-4,10H2,1-2H3,(H,24,26,28)