2-[2-(phenylmethyl)sulfonylbenzimidazol-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-(phenylmethyl)sulfonylbenzimidazol-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-(2-benzylsulfonylbenzimidazol-1-yl)-1-(1-piperidyl)ethanone CAS Name: 2-[2-(phenylmethyl)sulfonyl-1-benzimidazolyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-(2-benzylsulfonylbenzimidazol-1-yl)-1-piperidin-1-ylethanone Traditional Name: 2-(2-benzylsulfonylbenzimidazol-1-yl)-1-piperidino-ethanone Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S/c25-20(23-13-7-2-8-14-23)15-24-19-12-6-5-11-18(19)22-21(24)28(26,27)16-17-9-3-1-4-10-17/h1,3-6,9-12H,2,7-8,13-16H2