2-[(3S)-1-ethyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpyridine-3-carboxylate

Systemtic Name: 2-[(3S)-1-ethyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpyridine-3-carboxylate Openeye Name: 2-[(3S)-1-ethyl-2,5-dioxo-pyrrolidin-3-yl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[(3S)-1-ethyl-2,5-dioxo-3-pyrrolidinyl]thio]-3-pyridinecarboxylate IUPAC Name: 2-[(3S)-1-ethyl-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[(3S)-1-ethyl-2,5-diketo-pyrrolidin-3-yl]thio]nicotinate Formula: C12H11N2O4S- MolecularWeight: 279.29174

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CC(C1=O)SC2=C(C=CC=N2)C(=O)[O-]

Isomeric SMILES

CCN1C(=O)C[C@@H](C1=O)SC2=C(C=CC=N2)C(=O)[O-]

InChI

InChI=1S/C12H12N2O4S/c1-2-14-9(15)6-8(11(14)16)19-10-7(12(17)18)4-3-5-13-10/h3-5,8H,2,6H2,1H3,(H,17,18)/p-1/t8-/m0/s1