1-(4-methylpiperidin-1-yl)-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butan-1-one

Systemtic Name: 1-(4-methylpiperidin-1-yl)-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butan-1-one Openeye Name: 1-(4-methyl-1-piperidyl)-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butan-1-one CAS Name: 1-(4-methyl-1-piperidinyl)-4-[(1,4,5-triphenyl-2-imidazolyl)thio]-1-butanone IUPAC Name: 1-(4-methylpiperidin-1-yl)-4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutan-1-one Traditional Name: 1-(4-methylpiperidino)-4-[(1,4,5-triphenylimidazol-2-yl)thio]butan-1-one Formula: C31H33N3OS MolecularWeight: 495.67822

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CCCSC2=NC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1CCN(CC1)C(=O)CCCSC2=NC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H33N3OS/c1-24-19-21-33(22-20-24)28(35)18-11-23-36-31-32-29(25-12-5-2-6-13-25)30(26-14-7-3-8-15-26)34(31)27-16-9-4-10-17-27/h2-10,12-17,24H,11,18-23H2,1H3