(5E)-5-[(2-methylphenyl)methylidene]-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-phenyl-imidazol-4-one

Systemtic Name: (5E)-5-[(2-methylphenyl)methylidene]-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-phenyl-imidazol-4-one Openeye Name: (5E)-5-(o-tolylmethylene)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-phenyl-imidazol-4-one CAS Name: (5E)-5-[(2-methylphenyl)methylidene]-2-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-3-phenyl-4-imidazolone IUPAC Name: (5E)-5-[(2-methylphenyl)methylidene]-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-phenylimidazol-4-one Traditional Name: (5E)-2-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]-5-(2-methylbenzylidene)-3-phenyl-2-imidazolin-4-one Formula: C29H28N4O2S MolecularWeight: 496.62322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C2C(=O)N(C(=N2)SCC(=O)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1/C=C/2\C(=O)N(C(=N2)SCC(=O)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H28N4O2S/c1-22-10-8-9-11-23(22)20-26-28(35)33(25-14-6-3-7-15-25)29(30-26)36-21-27(34)32-18-16-31(17-19-32)24-12-4-2-5-13-24/h2-15,20H,16-19,21H2,1H3/b26-20+