2-(4-methylsulfanylphenyl)-3,4-bis(oxidanylidene)-5-phenyl-hexanedinitrile

Systemtic Name: 2-(4-methylsulfanylphenyl)-3,4-bis(oxidanylidene)-5-phenyl-hexanedinitrile Openeye Name: 2-(4-methylsulfanylphenyl)-3,4-dioxo-5-phenyl-hexanedinitrile CAS Name: 2-[4-(methylthio)phenyl]-3,4-dioxo-5-phenylhexanedinitrile IUPAC Name: 2-(4-methylsulfanylphenyl)-3,4-dioxo-5-phenylhexanedinitrile Traditional Name: 3,4-diketo-2-[4-(methylthio)phenyl]-5-phenyl-adiponitrile Formula: C19H14N2O2S MolecularWeight: 334.39166

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C#N)C(=O)C(=O)C(C#N)C2=CC=CC=C2

Isomeric SMILES

CSC1=CC=C(C=C1)C(C#N)C(=O)C(=O)C(C#N)C2=CC=CC=C2

InChI

InChI=1S/C19H14N2O2S/c1-24-15-9-7-14(8-10-15)17(12-21)19(23)18(22)16(11-20)13-5-3-2-4-6-13/h2-10,16-17H,1H3