3-[1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-(2,3,5,6-tetramethylphenyl)sulfonyl-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(=C1C)S(=O)(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O)C)C

InChI

InChI=1S/C22H27N3O3S/c1-14-13-15(2)17(4)21(16(14)3)29(27,28)24-11-9-18(10-12-24)25-20-8-6-5-7-19(20)23-22(25)26/h5-8,13,18H,9-12H2,1-4H3,(H,23,26)