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

Systemtic Name: (5E)-1-cyclopentyl-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: (5E)-1-cyclopentyl-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: (5E)-1-cyclopentyl-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: (5E)-1-cyclopentyl-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: (5E)-1-cyclopentyl-5-(3-methoxy-4-propargyloxy-benzylidene)barbituric acid Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCC3)OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C(=O)NC(=O)N(C2=O)C3CCCC3)OCC#C

InChI

InChI=1S/C20H20N2O5/c1-3-10-27-16-9-8-13(12-17(16)26-2)11-15-18(23)21-20(25)22(19(15)24)14-6-4-5-7-14/h1,8-9,11-12,14H,4-7,10H2,2H3,(H,21,23,25)/b15-11+