(2-methoxy-4-methylsulfanyl-phenyl)-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]methanone

Systemtic Name: (2-methoxy-4-methylsulfanyl-phenyl)-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]methanone Openeye Name: [4-[1-(4-benzyloxybutyl)imidazol-2-yl]-1-piperidyl]-(2-methoxy-4-methylsulfanyl-phenyl)methanone CAS Name: [2-methoxy-4-(methylthio)phenyl]-[4-[1-(4-phenylmethoxybutyl)-2-imidazolyl]-1-piperidinyl]methanone IUPAC Name: (2-methoxy-4-methylsulfanylphenyl)-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]methanone Traditional Name: [4-[1-(4-benzoxybutyl)imidazol-2-yl]piperidino]-[2-methoxy-4-(methylthio)phenyl]methanone Formula: C28H35N3O3S MolecularWeight: 493.6608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4

InChI

InChI=1S/C28H35N3O3S/c1-33-26-20-24(35-2)10-11-25(26)28(32)31-16-12-23(13-17-31)27-29-14-18-30(27)15-6-7-19-34-21-22-8-4-3-5-9-22/h3-5,8-11,14,18,20,23H,6-7,12-13,15-17,19,21H2,1-2H3