1-(3-bromanyl-4-fluoranyl-phenyl)-2-[(6-chloranyl-1-propyl-benzimidazol-2-yl)methyl]pent-4-en-1-one

Systemtic Name: 1-(3-bromanyl-4-fluoranyl-phenyl)-2-[(6-chloranyl-1-propyl-benzimidazol-2-yl)methyl]pent-4-en-1-one Openeye Name: 1-(3-bromo-4-fluoro-phenyl)-2-[(6-chloro-1-propyl-benzimidazol-2-yl)methyl]pent-4-en-1-one CAS Name: 1-(3-bromo-4-fluorophenyl)-2-[(6-chloro-1-propyl-2-benzimidazolyl)methyl]-4-penten-1-one IUPAC Name: 1-(3-bromo-4-fluorophenyl)-2-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]pent-4-en-1-one Traditional Name: 1-(3-bromo-4-fluoro-phenyl)-2-[(6-chloro-1-propyl-benzimidazol-2-yl)methyl]pent-4-en-1-one Formula: C22H21BrClFN2O MolecularWeight: 463.770343

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)Cl)N=C1CC(CC=C)C(=O)C3=CC(=C(C=C3)F)Br

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)Cl)N=C1CC(CC=C)C(=O)C3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C22H21BrClFN2O/c1-3-5-14(22(28)15-6-8-18(25)17(23)11-15)12-21-26-19-9-7-16(24)13-20(19)27(21)10-4-2/h3,6-9,11,13-14H,1,4-5,10,12H2,2H3