1-(3-bromophenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(3-bromophenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-allyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-1-(3-bromophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3-bromophenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(3-bromophenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-allyl-5-methoxy-4-propargyloxy-benzylidene)-1-(3-bromophenyl)barbituric acid Formula: C24H19BrN2O5 MolecularWeight: 495.32206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC#C)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC(=CC(=C1OCC#C)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C24H19BrN2O5/c1-4-7-16-11-15(13-20(31-3)21(16)32-10-5-2)12-19-22(28)26-24(30)27(23(19)29)18-9-6-8-17(25)14-18/h2,4,6,8-9,11-14H,1,7,10H2,3H3,(H,26,28,30)