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

Systemtic Name: 5-[(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-fluoro-4-pyrrolidin-1-yl-phenyl)methylene]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[3-fluoro-4-(1-pyrrolidinyl)phenyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-fluoro-4-pyrrolidin-1-ylphenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-fluoro-4-pyrrolidino-benzylidene)-1,3-dimethyl-barbituric acid Formula: C17H18FN3O3 MolecularWeight: 331.341523

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=C(C=C2)N3CCCC3)F)C(=O)N(C1=O)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC(=C(C=C2)N3CCCC3)F)C(=O)N(C1=O)C

InChI

InChI=1S/C17H18FN3O3/c1-19-15(22)12(16(23)20(2)17(19)24)9-11-5-6-14(13(18)10-11)21-7-3-4-8-21/h5-6,9-10H,3-4,7-8H2,1-2H3