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

Systemtic Name: 2,5-bis(4-methylsulfanylphenyl)-3,4-bis(oxidanylidene)hexanedinitrile Openeye Name: 2,5-bis(4-methylsulfanylphenyl)-3,4-dioxo-hexanedinitrile CAS Name: 2,5-bis[4-(methylthio)phenyl]-3,4-dioxohexanedinitrile IUPAC Name: 2,5-bis(4-methylsulfanylphenyl)-3,4-dioxohexanedinitrile Traditional Name: 3,4-diketo-2,5-bis[4-(methylthio)phenyl]adiponitrile Formula: C20H16N2O2S2 MolecularWeight: 380.48324

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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=C(C=C2)SC

Isomeric SMILES

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

InChI

InChI=1S/C20H16N2O2S2/c1-25-15-7-3-13(4-8-15)17(11-21)19(23)20(24)18(12-22)14-5-9-16(26-2)10-6-14/h3-10,17-18H,1-2H3