2-[2-(cyanomethylsulfanyl)ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-(cyanomethylsulfanyl)ethanoylamino]ethanoic acid Openeye Name: 2-[[2-(cyanomethylsulfanyl)acetyl]amino]acetic acid CAS Name: 2-[[2-(cyanomethylthio)-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-(cyanomethylsulfanyl)acetyl]amino]acetic acid Traditional Name: 2-[[2-(cyanomethylthio)acetyl]amino]acetic acid Formula: C6H8N2O3S MolecularWeight: 188.20432

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)SCC(=O)NCC(=O)O

Isomeric SMILES

C(C#N)SCC(=O)NCC(=O)O

InChI

InChI=1S/C6H8N2O3S/c7-1-2-12-4-5(9)8-3-6(10)11/h2-4H2,(H,8,9)(H,10,11)