ethyl 3-(ethylamino)-2-pyridin-2-yl-3-sulfanylidene-propanoate

Systemtic Name: ethyl 3-(ethylamino)-2-pyridin-2-yl-3-sulfanylidene-propanoate Openeye Name: ethyl 3-(ethylamino)-2-(2-pyridyl)-3-thioxo-propanoate CAS Name: 3-(ethylamino)-2-(2-pyridinyl)-3-sulfanylidenepropanoic acid ethyl ester IUPAC Name: ethyl 3-(ethylamino)-2-pyridin-2-yl-3-sulfanylidenepropanoate Traditional Name: 3-(ethylamino)-2-(2-pyridyl)-3-thioxo-propionic acid ethyl ester Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)C(C1=CC=CC=N1)C(=O)OCC

Isomeric SMILES

CCNC(=S)C(C1=CC=CC=N1)C(=O)OCC

InChI

InChI=1S/C12H16N2O2S/c1-3-13-11(17)10(12(15)16-4-2)9-7-5-6-8-14-9/h5-8,10H,3-4H2,1-2H3,(H,13,17)