methyl 2-[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: methyl 2-[2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[2-cyanoethyl(methyl)amino]-2-oxoethyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-cyanoethyl(methyl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl]thio]acetic acid methyl ester Formula: C9H14N2O3S MolecularWeight: 230.28406

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CSCC(=O)OC

Isomeric SMILES

CN(CCC#N)C(=O)CSCC(=O)OC

InChI

InChI=1S/C9H14N2O3S/c1-11(5-3-4-10)8(12)6-15-7-9(13)14-2/h3,5-7H2,1-2H3