1-[4-(3-phenylprop-2-enyl)piperazin-1-yl]-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butan-1-one

Systemtic Name: 1-[4-(3-phenylprop-2-enyl)piperazin-1-yl]-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butan-1-one Openeye Name: 1-(4-cinnamylpiperazin-1-yl)-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butan-1-one CAS Name: 1-[4-(3-phenylprop-2-enyl)-1-piperazinyl]-4-[(1,4,5-triphenyl-2-imidazolyl)thio]-1-butanone IUPAC Name: 1-[4-(3-phenylprop-2-enyl)piperazin-1-yl]-4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutan-1-one Traditional Name: 1-(4-cinnamylpiperazino)-4-[(1,4,5-triphenylimidazol-2-yl)thio]butan-1-one Formula: C38H38N4OS MolecularWeight: 598.79952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)CCCSC3=NC(=C(N3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)CCCSC3=NC(=C(N3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C38H38N4OS/c43-35(41-28-26-40(27-29-41)25-13-17-31-15-5-1-6-16-31)24-14-30-44-38-39-36(32-18-7-2-8-19-32)37(33-20-9-3-10-21-33)42(38)34-22-11-4-12-23-34/h1-13,15-23H,14,24-30H2