5-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(5-fluoro-2-methyl-4-pyrrolidin-1-yl-phenyl)methylene]-1-(4-methoxyphenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[5-fluoro-2-methyl-4-(1-pyrrolidinyl)phenyl]methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(5-fluoro-2-methyl-4-pyrrolidin-1-ylphenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(5-fluoro-2-methyl-4-pyrrolidino-benzylidene)-1-(4-methoxyphenyl)barbituric acid Formula: C23H22FN3O4 MolecularWeight: 423.436883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OC)F)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OC)F)N4CCCC4

InChI

InChI=1S/C23H22FN3O4/c1-14-11-20(26-9-3-4-10-26)19(24)13-15(14)12-18-21(28)25-23(30)27(22(18)29)16-5-7-17(31-2)8-6-16/h5-8,11-13H,3-4,9-10H2,1-2H3,(H,25,28,30)