3-[1-[3-(4-methylphenyl)sulfinyl-2-oxidanyl-propyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[3-(4-methylphenyl)sulfinyl-2-oxidanyl-propyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-hydroxy-3-(p-tolylsulfinyl)propyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-hydroxy-3-(4-methylphenyl)sulfinylpropyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-hydroxy-3-(4-methylphenyl)sulfinylpropyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-hydroxy-3-(p-tolylsulfinyl)propyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CC(CN2CCC(CC2)N3C4=CC=CC=C4NC3=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)CC(CN2CCC(CC2)N3C4=CC=CC=C4NC3=O)O

InChI

InChI=1S/C22H27N3O3S/c1-16-6-8-19(9-7-16)29(28)15-18(26)14-24-12-10-17(11-13-24)25-21-5-3-2-4-20(21)23-22(25)27/h2-9,17-18,26H,10-15H2,1H3,(H,23,27)