3,5-bis[(4-methylsulfanylphenyl)methylidene]-4-oxidanylidene-1-phenyl-cyclohexane-1-carbonitrile

Systemtic Name: 3,5-bis[(4-methylsulfanylphenyl)methylidene]-4-oxidanylidene-1-phenyl-cyclohexane-1-carbonitrile Openeye Name: 3,5-bis[(4-methylsulfanylphenyl)methylene]-4-oxo-1-phenyl-cyclohexanecarbonitrile CAS Name: 3,5-bis[[4-(methylthio)phenyl]methylidene]-4-oxo-1-phenyl-1-cyclohexanecarbonitrile IUPAC Name: 3,5-bis[(4-methylsulfanylphenyl)methylidene]-4-oxo-1-phenylcyclohexane-1-carbonitrile Traditional Name: 4-keto-3,5-bis[4-(methylthio)benzylidene]-1-phenyl-cyclohexanecarbonitrile Formula: C29H25NOS2 MolecularWeight: 467.6449

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C2CC(CC(=CC3=CC=C(C=C3)SC)C2=O)(C#N)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)C=C2CC(CC(=CC3=CC=C(C=C3)SC)C2=O)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C29H25NOS2/c1-32-26-12-8-21(9-13-26)16-23-18-29(20-30,25-6-4-3-5-7-25)19-24(28(23)31)17-22-10-14-27(33-2)15-11-22/h3-17H,18-19H2,1-2H3