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

Systemtic Name: 5-[[1-(4-bromanyl-2-fluoranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[1-(4-bromo-2-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-1-methyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[1-(4-bromo-2-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[1-(4-bromo-2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[1-(4-bromo-2-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-1-methyl-barbituric acid Formula: C18H15BrFN3O3 MolecularWeight: 420.232403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=C(C=C2)Br)F)C)C=C3C(=O)NC(=O)N(C3=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=C(C=C2)Br)F)C)C=C3C(=O)NC(=O)N(C3=O)C

InChI

InChI=1S/C18H15BrFN3O3/c1-9-6-11(7-13-16(24)21-18(26)22(3)17(13)25)10(2)23(9)15-5-4-12(19)8-14(15)20/h4-8H,1-3H3,(H,21,24,26)