(3E,5E)-3,5-bis[(3-methylthiophen-2-yl)methylidene]-4-oxidanylidene-1-phenyl-cyclohexane-1-carbonitrile

Systemtic Name: (3E,5E)-3,5-bis[(3-methylthiophen-2-yl)methylidene]-4-oxidanylidene-1-phenyl-cyclohexane-1-carbonitrile Openeye Name: (3E,5E)-3,5-bis[(3-methyl-2-thienyl)methylene]-4-oxo-1-phenyl-cyclohexanecarbonitrile CAS Name: (3E,5E)-3,5-bis[(3-methyl-2-thiophenyl)methylidene]-4-oxo-1-phenyl-1-cyclohexanecarbonitrile IUPAC Name: (3E,5E)-3,5-bis[(3-methylthiophen-2-yl)methylidene]-4-oxo-1-phenylcyclohexane-1-carbonitrile Traditional Name: (3E,5E)-4-keto-3,5-bis[(3-methyl-2-thienyl)methylene]-1-phenyl-cyclohexanecarbonitrile Formula: C25H21NOS2 MolecularWeight: 415.57034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=C2CC(CC(=CC3=C(C=CS3)C)C2=O)(C#N)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC=C1)/C=C\2/C(=O)/C(=C/C3=C(C=CS3)C)/CC(C2)(C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H21NOS2/c1-17-8-10-28-22(17)12-19-14-25(16-26,21-6-4-3-5-7-21)15-20(24(19)27)13-23-18(2)9-11-29-23/h3-13H,14-15H2,1-2H3/b19-12+,20-13+