3-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylpropanoate

Systemtic Name: 3-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylpropanoate Openeye Name: 3-[2-(isopropylamino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]propanoate IUPAC Name: 3-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylpropanoate Traditional Name: 3-[[2-(isopropylamino)-2-keto-ethyl]thio]propionate Formula: C8H14NO3S- MolecularWeight: 204.26666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSCCC(=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CSCCC(=O)[O-]

InChI

InChI=1S/C8H15NO3S/c1-6(2)9-7(10)5-13-4-3-8(11)12/h6H,3-5H2,1-2H3,(H,9,10)(H,11,12)/p-1