2-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]sulfanylethanoate

Systemtic Name: 2-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]sulfanylethanoate Openeye Name: 2-[2-oxo-2-(prop-2-ynylamino)ethyl]sulfanylacetate CAS Name: 2-[[2-oxo-2-(prop-2-ynylamino)ethyl]thio]acetate IUPAC Name: 2-[2-oxo-2-(prop-2-ynylamino)ethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(propargylamino)ethyl]thio]acetate Formula: C7H8NO3S- MolecularWeight: 186.20832

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)CSCC(=O)[O-]

Isomeric SMILES

C#CCNC(=O)CSCC(=O)[O-]

InChI

InChI=1S/C7H9NO3S/c1-2-3-8-6(9)4-12-5-7(10)11/h1H,3-5H2,(H,8,9)(H,10,11)/p-1