1-(4-bromanyl-3-methyl-phenyl)-5-[(3-methoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-5-[(3-methoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-allyl-4-hydroxy-5-methoxy-phenyl)methylene]-1-(4-bromo-3-methyl-phenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-bromo-3-methylphenyl)-5-[(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-bromo-3-methylphenyl)-5-[(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-allyl-4-hydroxy-5-methoxy-benzylidene)-1-(4-bromo-3-methyl-phenyl)barbituric acid Formula: C22H19BrN2O5 MolecularWeight: 471.30066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)CC=C)C(=O)NC2=O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)CC=C)C(=O)NC2=O)Br

InChI

InChI=1S/C22H19BrN2O5/c1-4-5-14-9-13(11-18(30-3)19(14)26)10-16-20(27)24-22(29)25(21(16)28)15-6-7-17(23)12(2)8-15/h4,6-11,26H,1,5H2,2-3H3,(H,24,27,29)