N-[2-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]-4-fluoranyl-benzamide Openeye Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]-4-fluoro-benzamide CAS Name: N-[2-[(4-acetyl-1-piperazin-1-iumyl)methyl]-1-methyl-5-benzimidazolyl]-4-fluorobenzamide IUPAC Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methylbenzimidazol-5-yl]-4-fluorobenzamide Traditional Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]-4-fluoro-benzamide Formula: C22H25FN5O2+ MolecularWeight: 410.464603

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC2=NC3=C(N2C)C=CC(=C3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC2=NC3=C(N2C)C=CC(=C3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN5O2/c1-15(29)28-11-9-27(10-12-28)14-21-25-19-13-18(7-8-20(19)26(21)2)24-22(30)16-3-5-17(23)6-4-16/h3-8,13H,9-12,14H2,1-2H3,(H,24,30)/p+1