5-[[(3,5-dimethoxyphenyl)methylamino]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[(3,5-dimethoxyphenyl)methylamino]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[(3,5-dimethoxyphenyl)methylamino]methylene]-1-(4-fluorophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[(3,5-dimethoxyphenyl)methylamino]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[(3,5-dimethoxyphenyl)methylamino]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[(3,5-dimethoxybenzyl)amino]methylene]-1-(4-fluorophenyl)barbituric acid Formula: C20H18FN3O5 MolecularWeight: 399.372423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C20H18FN3O5/c1-28-15-7-12(8-16(9-15)29-2)10-22-11-17-18(25)23-20(27)24(19(17)26)14-5-3-13(21)4-6-14/h3-9,11,22H,10H2,1-2H3,(H,23,25,27)