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

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-5-[(3-ethoxy-4-methoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-bromo-3-methyl-phenyl)-5-[(3-ethoxy-4-methoxy-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-bromo-3-methylphenyl)-5-[(3-ethoxy-4-methoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-bromo-3-methylphenyl)-5-[(3-ethoxy-4-methoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-bromo-3-methyl-phenyl)-5-(3-ethoxy-4-methoxy-benzylidene)barbituric acid Formula: C21H19BrN2O5 MolecularWeight: 459.28996

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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)Br)C)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrN2O5/c1-4-29-18-11-13(5-8-17(18)28-3)10-15-19(25)23-21(27)24(20(15)26)14-6-7-16(22)12(2)9-14/h5-11H,4H2,1-3H3,(H,23,25,27)