1-[1-[2-(4-chlorophenyl)-2-oxidanyl-ethyl]piperidin-4-yl]-6-fluoranyl-2-oxidanylidene-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-3H-benzimidazole-5-carboxamide

Systemtic Name: 1-[1-[2-(4-chlorophenyl)-2-oxidanyl-ethyl]piperidin-4-yl]-6-fluoranyl-2-oxidanylidene-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-3H-benzimidazole-5-carboxamide Openeye Name: 1-[1-[2-(4-chlorophenyl)-2-hydroxy-ethyl]-4-piperidyl]-6-fluoro-2-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-3H-benzimidazole-5-carboxamide CAS Name: 1-[1-[2-(4-chlorophenyl)-2-hydroxyethyl]-4-piperidinyl]-6-fluoro-2-oxo-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3H-benzimidazole-5-carboxamide IUPAC Name: 1-[1-[2-(4-chlorophenyl)-2-hydroxyethyl]piperidin-4-yl]-6-fluoro-2-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-3H-benzimidazole-5-carboxamide Traditional Name: 1-[1-[2-(4-chlorophenyl)-2-hydroxy-ethyl]-4-piperidyl]-6-fluoro-2-keto-N-[3-(2-ketopyrrolidino)propyl]-3H-benzimidazole-5-carboxamide Formula: C28H33ClFN5O4 MolecularWeight: 558.044123

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=O)C2=CC3=C(C=C2F)N(C(=O)N3)C4CCN(CC4)CC(C5=CC=C(C=C5)Cl)O

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=O)C2=CC3=C(C=C2F)N(C(=O)N3)C4CCN(CC4)CC(C5=CC=C(C=C5)Cl)O

InChI

InChI=1S/C28H33ClFN5O4/c29-19-6-4-18(5-7-19)25(36)17-33-13-8-20(9-14-33)35-24-16-22(30)21(15-23(24)32-28(35)39)27(38)31-10-2-12-34-11-1-3-26(34)37/h4-7,15-16,20,25,36H,1-3,8-14,17H2,(H,31,38)(H,32,39)