3-[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(isopropylcarbamoylamino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl]thio]propanoic acid IUPAC Name: 3-[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-(isopropylcarbamoylamino)-2-keto-ethyl]thio]propionic acid Formula: C9H16N2O4S MolecularWeight: 248.29934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)CSCCC(=O)O

Isomeric SMILES

CC(C)NC(=O)NC(=O)CSCCC(=O)O

InChI

InChI=1S/C9H16N2O4S/c1-6(2)10-9(15)11-7(12)5-16-4-3-8(13)14/h6H,3-5H2,1-2H3,(H,13,14)(H2,10,11,12,15)