1-(3,5-dimethylpiperidin-1-yl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-(3,5-dimethylpiperidin-1-yl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanone Openeye Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-1-(3,5-dimethyl-1-piperidyl)ethanone CAS Name: 1-(3,5-dimethyl-1-piperidinyl)-2-[2-(phenylmethylthio)-1-benzimidazolyl]ethanone IUPAC Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone Traditional Name: 2-[2-(benzylthio)benzimidazol-1-yl]-1-(3,5-dimethylpiperidino)ethanone Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2C3=CC=CC=C3N=C2SCC4=CC=CC=C4)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2C3=CC=CC=C3N=C2SCC4=CC=CC=C4)C

InChI

InChI=1S/C23H27N3OS/c1-17-12-18(2)14-25(13-17)22(27)15-26-21-11-7-6-10-20(21)24-23(26)28-16-19-8-4-3-5-9-19/h3-11,17-18H,12-16H2,1-2H3