5-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-1-(4-methylpiperidin-1-yl)pentan-1-one

Systemtic Name: 5-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-1-(4-methylpiperidin-1-yl)pentan-1-one Openeye Name: 5-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-1-(4-methyl-1-piperidyl)pentan-1-one CAS Name: 5-[(1-ethyl-4,5-diphenyl-2-imidazolyl)thio]-1-(4-methyl-1-piperidinyl)-1-pentanone IUPAC Name: 5-(1-ethyl-4,5-diphenylimidazol-2-yl)sulfanyl-1-(4-methylpiperidin-1-yl)pentan-1-one Traditional Name: 5-[(1-ethyl-4,5-diphenyl-imidazol-2-yl)thio]-1-(4-methylpiperidino)pentan-1-one Formula: C28H35N3OS MolecularWeight: 461.662

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCCC(=O)N2CCC(CC2)C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=C(N=C1SCCCCC(=O)N2CCC(CC2)C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H35N3OS/c1-3-31-27(24-14-8-5-9-15-24)26(23-12-6-4-7-13-23)29-28(31)33-21-11-10-16-25(32)30-19-17-22(2)18-20-30/h4-9,12-15,22H,3,10-11,16-21H2,1-2H3