1-[[1-(5-fluoranyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]methyl]-2-(phenoxymethyl)benzimidazole

Systemtic Name: 1-[[1-(5-fluoranyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]methyl]-2-(phenoxymethyl)benzimidazole Openeye Name: 1-[[1-(5-fluoro-2-methoxy-phenyl)sulfonyl-4-piperidyl]methyl]-2-(phenoxymethyl)benzimidazole CAS Name: 1-[[1-(5-fluoro-2-methoxyphenyl)sulfonyl-4-piperidinyl]methyl]-2-(phenoxymethyl)benzimidazole IUPAC Name: 1-[[1-(5-fluoro-2-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-2-(phenoxymethyl)benzimidazole Traditional Name: 1-[[1-(5-fluoro-2-methoxy-phenyl)sulfonyl-4-piperidyl]methyl]-2-(phenoxymethyl)benzimidazole Formula: C27H28FN3O4S MolecularWeight: 509.592323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)S(=O)(=O)N2CCC(CC2)CN3C4=CC=CC=C4N=C3COC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)F)S(=O)(=O)N2CCC(CC2)CN3C4=CC=CC=C4N=C3COC5=CC=CC=C5

InChI

InChI=1S/C27H28FN3O4S/c1-34-25-12-11-21(28)17-26(25)36(32,33)30-15-13-20(14-16-30)18-31-24-10-6-5-9-23(24)29-27(31)19-35-22-7-3-2-4-8-22/h2-12,17,20H,13-16,18-19H2,1H3