ethyl 2-[2-(3-cyanopyridin-2-yl)sulfanylethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-(3-cyanopyridin-2-yl)sulfanylethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[(3-cyano-2-pyridyl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[(3-cyano-2-pyridinyl)thio]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-cyanopyridin-2-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(3-cyano-2-pyridyl)thio]acetyl]amino]acetic acid ethyl ester Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CSC1=C(C=CC=N1)C#N

Isomeric SMILES

CCOC(=O)CNC(=O)CSC1=C(C=CC=N1)C#N

InChI

InChI=1S/C12H13N3O3S/c1-2-18-11(17)7-15-10(16)8-19-12-9(6-13)4-3-5-14-12/h3-5H,2,7-8H2,1H3,(H,15,16)