1-[[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]methyl]-2-methyl-benzimidazole

Systemtic Name: 1-[[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]methyl]-2-methyl-benzimidazole Openeye Name: 1-[[1-(2,5-dimethoxyphenyl)sulfonyl-4-piperidyl]methyl]-2-methyl-benzimidazole CAS Name: 1-[[1-(2,5-dimethoxyphenyl)sulfonyl-4-piperidinyl]methyl]-2-methylbenzimidazole IUPAC Name: 1-[[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]methyl]-2-methylbenzimidazole Traditional Name: 1-[[1-(2,5-dimethoxyphenyl)sulfonyl-4-piperidyl]methyl]-2-methyl-benzimidazole Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S/c1-16-23-19-6-4-5-7-20(19)25(16)15-17-10-12-24(13-11-17)30(26,27)22-14-18(28-2)8-9-21(22)29-3/h4-9,14,17H,10-13,15H2,1-3H3