1-[[1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-4-yl]methyl]-2-methyl-benzimidazole

Systemtic Name: 1-[[1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-4-yl]methyl]-2-methyl-benzimidazole Openeye Name: 1-[[1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-piperidyl]methyl]-2-methyl-benzimidazole CAS Name: 1-[[1-(3-chloro-4-fluorophenyl)sulfonyl-4-piperidinyl]methyl]-2-methylbenzimidazole IUPAC Name: 1-[[1-(3-chloro-4-fluorophenyl)sulfonylpiperidin-4-yl]methyl]-2-methylbenzimidazole Traditional Name: 1-[[1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-piperidyl]methyl]-2-methyl-benzimidazole Formula: C20H21ClFN3O2S MolecularWeight: 421.916043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CC3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CC3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H21ClFN3O2S/c1-14-23-19-4-2-3-5-20(19)25(14)13-15-8-10-24(11-9-15)28(26,27)16-6-7-18(22)17(21)12-16/h2-7,12,15H,8-11,13H2,1H3