methyl 2-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoylamino]ethanoate

Systemtic Name: methyl 2-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoylamino]ethanoate Openeye Name: methyl 2-[3-(2-amino-2-oxo-ethyl)sulfanylpropanoylamino]acetate CAS Name: 2-[[3-[(2-amino-2-oxoethyl)thio]-1-oxopropyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[3-(2-amino-2-oxoethyl)sulfanylpropanoylamino]acetate Traditional Name: 2-[3-[(2-amino-2-keto-ethyl)thio]propanoylamino]acetic acid methyl ester Formula: C8H14N2O4S MolecularWeight: 234.27276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CCSCC(=O)N

Isomeric SMILES

COC(=O)CNC(=O)CCSCC(=O)N

InChI

InChI=1S/C8H14N2O4S/c1-14-8(13)4-10-7(12)2-3-15-5-6(9)11/h2-5H2,1H3,(H2,9,11)(H,10,12)