1-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]methyl]benzimidazole

Systemtic Name: 1-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]methyl]benzimidazole Openeye Name: 1-[[1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidyl]methyl]benzimidazole CAS Name: 1-[[1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidinyl]methyl]benzimidazole IUPAC Name: 1-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]methyl]benzimidazole Traditional Name: 1-[[1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidyl]methyl]benzimidazole Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)CN3C=NC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)CN3C=NC4=CC=CC=C43)OC

InChI

InChI=1S/C21H25N3O4S/c1-27-20-8-7-17(13-21(20)28-2)29(25,26)24-11-9-16(10-12-24)14-23-15-22-18-5-3-4-6-19(18)23/h3-8,13,15-16H,9-12,14H2,1-2H3