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

Systemtic Name: 1-(3,5-dimethylphenyl)-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(3,5-dimethylphenyl)-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3,5-dimethylphenyl)-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(3,5-dimethylphenyl)-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(3,5-dimethylphenyl)-5-(3-methoxy-4-propargyloxy-benzylidene)barbituric acid Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O5/c1-5-8-30-19-7-6-16(13-20(19)29-4)12-18-21(26)24-23(28)25(22(18)27)17-10-14(2)9-15(3)11-17/h1,6-7,9-13H,8H2,2-4H3,(H,24,26,28)