2-[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(allylcarbamoylamino)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl]thio]acetic acid IUPAC Name: 2-[2-oxo-2-(prop-2-enylcarbamoylamino)ethyl]sulfanylacetic acid Traditional Name: 2-[[2-(allylcarbamoylamino)-2-keto-ethyl]thio]acetic acid Formula: C8H12N2O4S MolecularWeight: 232.25688

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)CSCC(=O)O

Isomeric SMILES

C=CCNC(=O)NC(=O)CSCC(=O)O

InChI

InChI=1S/C8H12N2O4S/c1-2-3-9-8(14)10-6(11)4-15-5-7(12)13/h2H,1,3-5H2,(H,12,13)(H2,9,10,11,14)