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

Systemtic Name: 1-[[1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-4-yl]methyl]-2-(phenoxymethyl)benzimidazole Openeye Name: 1-[[1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-piperidyl]methyl]-2-(phenoxymethyl)benzimidazole CAS Name: 1-[[1-(3-chloro-4-fluorophenyl)sulfonyl-4-piperidinyl]methyl]-2-(phenoxymethyl)benzimidazole IUPAC Name: 1-[[1-(3-chloro-4-fluorophenyl)sulfonylpiperidin-4-yl]methyl]-2-(phenoxymethyl)benzimidazole Traditional Name: 1-[[1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-piperidyl]methyl]-2-(phenoxymethyl)benzimidazole Formula: C26H25ClFN3O3S MolecularWeight: 514.011403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C3=CC=CC=C3N=C2COC4=CC=CC=C4)S(=O)(=O)C5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1CN(CCC1CN2C3=CC=CC=C3N=C2COC4=CC=CC=C4)S(=O)(=O)C5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C26H25ClFN3O3S/c27-22-16-21(10-11-23(22)28)35(32,33)30-14-12-19(13-15-30)17-31-25-9-5-4-8-24(25)29-26(31)18-34-20-6-2-1-3-7-20/h1-11,16,19H,12-15,17-18H2