N-(1H-benzimidazol-2-ylmethyl)-1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4-oxidanyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4-oxidanyl-pyrrolidine-2-carboxamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(4-bromo-2-fluoro-phenyl)methyl]-4-hydroxy-pyrrolidine-2-carboxamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(4-bromo-2-fluorophenyl)methyl]-4-hydroxy-2-pyrrolidinecarboxamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(4-bromo-2-fluorophenyl)methyl]-4-hydroxypyrrolidine-2-carboxamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-1-(4-bromo-2-fluoro-benzyl)-4-hydroxy-pyrrolidine-2-carboxamide Formula: C20H20BrFN4O2 MolecularWeight: 447.300803

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)NCC2=NC3=CC=CC=C3N2)CC4=C(C=C(C=C4)Br)F)O

Isomeric SMILES

C1C(CN(C1C(=O)NCC2=NC3=CC=CC=C3N2)CC4=C(C=C(C=C4)Br)F)O

InChI

InChI=1S/C20H20BrFN4O2/c21-13-6-5-12(15(22)7-13)10-26-11-14(27)8-18(26)20(28)23-9-19-24-16-3-1-2-4-17(16)25-19/h1-7,14,18,27H,8-11H2,(H,23,28)(H,24,25)