2-(3-oxidanylidene-1-phenyl-2-phenylsulfanyl-butyl)propanedinitrile

Systemtic Name: 2-(3-oxidanylidene-1-phenyl-2-phenylsulfanyl-butyl)propanedinitrile Openeye Name: 2-(3-oxo-1-phenyl-2-phenylsulfanyl-butyl)propanedinitrile CAS Name: 2-[3-oxo-1-phenyl-2-(phenylthio)butyl]propanedinitrile IUPAC Name: 2-(3-oxo-1-phenyl-2-phenylsulfanylbutyl)propanedinitrile Traditional Name: 2-[3-keto-1-phenyl-2-(phenylthio)butyl]malononitrile Formula: C19H16N2OS MolecularWeight: 320.40814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C1=CC=CC=C1)C(C#N)C#N)SC2=CC=CC=C2

Isomeric SMILES

CC(=O)C(C(C1=CC=CC=C1)C(C#N)C#N)SC2=CC=CC=C2

InChI

InChI=1S/C19H16N2OS/c1-14(22)19(23-17-10-6-3-7-11-17)18(16(12-20)13-21)15-8-4-2-5-9-15/h2-11,16,18-19H,1H3