methyl 2-[3-[2-cyanoethyl(methyl)amino]-3-oxidanylidene-propyl]sulfanylethanoate

Systemtic Name: methyl 2-[3-[2-cyanoethyl(methyl)amino]-3-oxidanylidene-propyl]sulfanylethanoate Openeye Name: methyl 2-[3-[2-cyanoethyl(methyl)amino]-3-oxo-propyl]sulfanylacetate CAS Name: 2-[[3-[2-cyanoethyl(methyl)amino]-3-oxopropyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[3-[2-cyanoethyl(methyl)amino]-3-oxopropyl]sulfanylacetate Traditional Name: 2-[[3-[2-cyanoethyl(methyl)amino]-3-keto-propyl]thio]acetic acid methyl ester Formula: C10H16N2O3S MolecularWeight: 244.31064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N2O3S/c1-12(6-3-5-11)9(13)4-7-16-8-10(14)15-2/h3-4,6-8H2,1-2H3