2-[1-(2,4-dimethylphenyl)-3-oxidanylidene-3-thiophen-2-yl-propyl]propanedinitrile

Systemtic Name: 2-[1-(2,4-dimethylphenyl)-3-oxidanylidene-3-thiophen-2-yl-propyl]propanedinitrile Openeye Name: 2-[1-(2,4-dimethylphenyl)-3-oxo-3-(2-thienyl)propyl]propanedinitrile CAS Name: 2-[1-(2,4-dimethylphenyl)-3-oxo-3-thiophen-2-ylpropyl]propanedinitrile IUPAC Name: 2-[1-(2,4-dimethylphenyl)-3-oxo-3-thiophen-2-ylpropyl]propanedinitrile Traditional Name: 2-[1-(2,4-dimethylphenyl)-3-keto-3-(2-thienyl)propyl]malononitrile Formula: C18H16N2OS MolecularWeight: 308.39744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(CC(=O)C2=CC=CS2)C(C#N)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(CC(=O)C2=CC=CS2)C(C#N)C#N)C

InChI

InChI=1S/C18H16N2OS/c1-12-5-6-15(13(2)8-12)16(14(10-19)11-20)9-17(21)18-4-3-7-22-18/h3-8,14,16H,9H2,1-2H3