(2E)-2-[azanyl(sulfanyl)methylidene]-3-oxidanylidene-butanenitrile

Systemtic Name: (2E)-2-[azanyl(sulfanyl)methylidene]-3-oxidanylidene-butanenitrile Openeye Name: (2E)-2-[amino(sulfanyl)methylene]-3-oxo-butanenitrile CAS Name: (2E)-2-[amino(mercapto)methylidene]-3-oxobutanenitrile IUPAC Name: (2E)-2-[amino(sulfanyl)methylidene]-3-oxobutanenitrile Traditional Name: (E)-2-acetyl-3-amino-3-mercapto-acrylonitrile Formula: C5H6N2OS MolecularWeight: 142.17894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(N)S)C#N

Isomeric SMILES

CC(=O)/C(=C(\N)/S)/C#N

InChI

InChI=1S/C5H6N2OS/c1-3(8)4(2-6)5(7)9/h9H,7H2,1H3/b5-4+