2-[2-(cyanomethylsulfanyl)ethanoyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[2-(cyanomethylsulfanyl)ethanoyl-methyl-amino]ethanoic acid Openeye Name: 2-[[2-(cyanomethylsulfanyl)acetyl]-methyl-amino]acetic acid CAS Name: 2-[[2-(cyanomethylthio)-1-oxoethyl]-methylamino]acetic acid IUPAC Name: 2-[[2-(cyanomethylsulfanyl)acetyl]-methylamino]acetic acid Traditional Name: 2-[[2-(cyanomethylthio)acetyl]-methyl-amino]acetic acid Formula: C7H10N2O3S MolecularWeight: 202.2309

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)CSCC#N

Isomeric SMILES

CN(CC(=O)O)C(=O)CSCC#N

InChI

InChI=1S/C7H10N2O3S/c1-9(4-7(11)12)6(10)5-13-3-2-8/h3-5H2,1H3,(H,11,12)