3-[1,3-bis(oxidanylidene)isoindol-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]sulfanylpropanenitrile Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)sulfanylpropanenitrile CAS Name: 3-[(1,3-dioxo-2-isoindolyl)thio]propanenitrile IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)sulfanylpropanenitrile Traditional Name: 3-(phthalimidothio)propionitrile Formula: C11H8N2O2S MolecularWeight: 232.25842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)SCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)SCCC#N

InChI

InChI=1S/C11H8N2O2S/c12-6-3-7-16-13-10(14)8-4-1-2-5-9(8)11(13)15/h1-2,4-5H,3,7H2