3-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanyl-1-piperidin-1-yl-propan-1-one

Systemtic Name: 3-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanyl-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-1-(1-piperidyl)propan-1-one CAS Name: 3-[[1-(benzenesulfonyl)-2-benzimidazolyl]thio]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[(1-besylbenzimidazol-2-yl)thio]-1-piperidino-propan-1-one Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCSC2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CCSC2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S2/c25-20(23-14-7-2-8-15-23)13-16-28-21-22-18-11-5-6-12-19(18)24(21)29(26,27)17-9-3-1-4-10-17/h1,3-6,9-12H,2,7-8,13-16H2