methyl 2-[2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]acetyl]amino]acetic acid methyl ester Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NCC(=O)OC)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NCC(=O)OC)C

InChI

InChI=1S/C14H17N3O3S/c1-8-9(2)11(5-15)14(17-10(8)3)21-7-12(18)16-6-13(19)20-4/h6-7H2,1-4H3,(H,16,18)