methyl 1-(2-pyridin-3-ylethanoyl)-4-sulfanylidene-pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(2-pyridin-3-ylethanoyl)-4-sulfanylidene-pyrrolidine-2-carboxylate Openeye Name: methyl 1-[2-(3-pyridyl)acetyl]-4-thioxo-pyrrolidine-2-carboxylate CAS Name: 1-[1-oxo-2-(3-pyridinyl)ethyl]-4-sulfanylidene-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-pyridin-3-ylacetyl)-4-sulfanylidenepyrrolidine-2-carboxylate Traditional Name: 1-[2-(3-pyridyl)acetyl]-4-thioxo-pyrrolidine-2-carboxylic acid methyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=S)CN1C(=O)CC2=CN=CC=C2

Isomeric SMILES

COC(=O)C1CC(=S)CN1C(=O)CC2=CN=CC=C2

InChI

InChI=1S/C13H14N2O3S/c1-18-13(17)11-6-10(19)8-15(11)12(16)5-9-3-2-4-14-7-9/h2-4,7,11H,5-6,8H2,1H3