2-(benzimidazol-1-yl)-1-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-(benzimidazol-1-yl)-1-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 2-(benzimidazol-1-yl)-1-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]propan-1-one CAS Name: 2-(1-benzimidazolyl)-1-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(benzimidazol-1-yl)-1-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 2-(benzimidazol-1-yl)-1-[4-(2-chloro-4-fluoro-benzyl)piperazino]propan-1-one Formula: C21H22ClFN4O MolecularWeight: 400.876983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=C(C=C(C=C2)F)Cl)N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=C(C=C(C=C2)F)Cl)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C21H22ClFN4O/c1-15(27-14-24-19-4-2-3-5-20(19)27)21(28)26-10-8-25(9-11-26)13-16-6-7-17(23)12-18(16)22/h2-7,12,14-15H,8-11,13H2,1H3