methyl 2-[2-(cyanomethylsulfanyl)ethanoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[2-(cyanomethylsulfanyl)ethanoylamino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[[2-(cyanomethylsulfanyl)acetyl]amino]-3-hydroxy-propanoate CAS Name: 2-[[2-(cyanomethylthio)-1-oxoethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[[2-(cyanomethylsulfanyl)acetyl]amino]-3-hydroxypropanoate Traditional Name: 2-[[2-(cyanomethylthio)acetyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C8H12N2O4S MolecularWeight: 232.25688

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CSCC#N

Isomeric SMILES

COC(=O)C(CO)NC(=O)CSCC#N

InChI

InChI=1S/C8H12N2O4S/c1-14-8(13)6(4-11)10-7(12)5-15-3-2-9/h6,11H,3-5H2,1H3,(H,10,12)