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

Systemtic Name: 1-[[1-(2-methoxy-5-methyl-phenyl)sulfonylpiperidin-4-yl]methyl]-2-methyl-benzimidazole Openeye Name: 1-[[1-(2-methoxy-5-methyl-phenyl)sulfonyl-4-piperidyl]methyl]-2-methyl-benzimidazole CAS Name: 1-[[1-(2-methoxy-5-methylphenyl)sulfonyl-4-piperidinyl]methyl]-2-methylbenzimidazole IUPAC Name: 1-[[1-(2-methoxy-5-methylphenyl)sulfonylpiperidin-4-yl]methyl]-2-methylbenzimidazole Traditional Name: 1-[[1-(2-methoxy-5-methyl-phenyl)sulfonyl-4-piperidyl]methyl]-2-methyl-benzimidazole Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)CN3C(=NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)CN3C(=NC4=CC=CC=C43)C

InChI

InChI=1S/C22H27N3O3S/c1-16-8-9-21(28-3)22(14-16)29(26,27)24-12-10-18(11-13-24)15-25-17(2)23-19-6-4-5-7-20(19)25/h4-9,14,18H,10-13,15H2,1-3H3