2-butylsulfanyl-3-sulfanylidene-isoindol-1-one

Systemtic Name: 2-butylsulfanyl-3-sulfanylidene-isoindol-1-one Openeye Name: 2-butylsulfanyl-3-thioxo-isoindolin-1-one CAS Name: 2-(butylthio)-3-sulfanylidene-1-isoindolone IUPAC Name: 2-butylsulfanyl-3-sulfanylideneisoindol-1-one Traditional Name: 2-(butylthio)-3-thioxo-isoindolin-1-one Formula: C12H13NOS2 MolecularWeight: 251.36772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSN1C(=O)C2=CC=CC=C2C1=S

Isomeric SMILES

CCCCSN1C(=O)C2=CC=CC=C2C1=S

InChI

InChI=1S/C12H13NOS2/c1-2-3-8-16-13-11(14)9-6-4-5-7-10(9)12(13)15/h4-7H,2-3,8H2,1H3