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

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(4-bromophenyl)methyl]-4-oxidanyl-pyrrolidine-2-carboxamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(4-bromophenyl)methyl]-4-hydroxy-pyrrolidine-2-carboxamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(4-bromophenyl)methyl]-4-hydroxy-2-pyrrolidinecarboxamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(4-bromophenyl)methyl]-4-hydroxypyrrolidine-2-carboxamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-1-(4-bromobenzyl)-4-hydroxy-pyrrolidine-2-carboxamide Formula: C20H21BrN4O2 MolecularWeight: 429.31034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrN4O2/c21-14-7-5-13(6-8-14)11-25-12-15(26)9-18(25)20(27)22-10-19-23-16-3-1-2-4-17(16)24-19/h1-8,15,18,26H,9-12H2,(H,22,27)(H,23,24)