N-[bis(azanyl)methylidene]-1-(4-bromanyl-2-fluoranyl-phenyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-1-(4-bromanyl-2-fluoranyl-phenyl)pyrrolidine-2-carboxamide Openeye Name: 1-(4-bromo-2-fluoro-phenyl)-N-(diaminomethylene)pyrrolidine-2-carboxamide CAS Name: 1-(4-bromo-2-fluorophenyl)-N-(diaminomethylidene)-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-bromo-2-fluorophenyl)-N-(diaminomethylidene)pyrrolidine-2-carboxamide Traditional Name: 1-(4-bromo-2-fluoro-phenyl)-N-(diaminomethylene)pyrrolidine-2-carboxamide Formula: C12H14BrFN4O MolecularWeight: 329.168163

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C=C(C=C2)Br)F)C(=O)N=C(N)N

Isomeric SMILES

C1CC(N(C1)C2=C(C=C(C=C2)Br)F)C(=O)N=C(N)N

InChI

InChI=1S/C12H14BrFN4O/c13-7-3-4-9(8(14)6-7)18-5-1-2-10(18)11(19)17-12(15)16/h3-4,6,10H,1-2,5H2,(H4,15,16,17,19)