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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)C)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)C)Br)OCC

InChI

InChI=1S/C22H21BrN2O5/c1-4-29-18-12-14(11-17(23)19(18)30-5-2)10-16-20(26)24-22(28)25(21(16)27)15-8-6-13(3)7-9-15/h6-12H,4-5H2,1-3H3,(H,24,26,28)