2-(benzimidazol-1-yl)-1-[3-(2-methylsulfanylphenyl)carbonylpiperidin-1-yl]ethanone

Systemtic Name: 2-(benzimidazol-1-yl)-1-[3-(2-methylsulfanylphenyl)carbonylpiperidin-1-yl]ethanone Openeye Name: 2-(benzimidazol-1-yl)-1-[3-(2-methylsulfanylbenzoyl)-1-piperidyl]ethanone CAS Name: 2-(1-benzimidazolyl)-1-[3-[[2-(methylthio)phenyl]-oxomethyl]-1-piperidinyl]ethanone IUPAC Name: 2-(benzimidazol-1-yl)-1-[3-(2-methylsulfanylbenzoyl)piperidin-1-yl]ethanone Traditional Name: 2-(benzimidazol-1-yl)-1-[3-[2-(methylthio)benzoyl]piperidino]ethanone Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C(=O)CN3C=NC4=CC=CC=C43

Isomeric SMILES

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C(=O)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H23N3O2S/c1-28-20-11-5-2-8-17(20)22(27)16-7-6-12-24(13-16)21(26)14-25-15-23-18-9-3-4-10-19(18)25/h2-5,8-11,15-16H,6-7,12-14H2,1H3