(2-methylsulfanylphenyl)-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]methanone

Systemtic Name: (2-methylsulfanylphenyl)-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]methanone Openeye Name: [4-[1-(4-benzyloxybutyl)imidazol-2-yl]-1-piperidyl]-(2-methylsulfanylphenyl)methanone CAS Name: [2-(methylthio)phenyl]-[4-[1-(4-phenylmethoxybutyl)-2-imidazolyl]-1-piperidinyl]methanone IUPAC Name: (2-methylsulfanylphenyl)-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]methanone Traditional Name: [4-[1-(4-benzoxybutyl)imidazol-2-yl]piperidino]-[2-(methylthio)phenyl]methanone Formula: C27H33N3O2S MolecularWeight: 463.63482

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4

InChI

InChI=1S/C27H33N3O2S/c1-33-25-12-6-5-11-24(25)27(31)30-17-13-23(14-18-30)26-28-15-19-29(26)16-7-8-20-32-21-22-9-3-2-4-10-22/h2-6,9-12,15,19,23H,7-8,13-14,16-18,20-21H2,1H3