[2-oxidanylidene-2-[2-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)ethylamino]ethyl] pyridine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)ethylamino]ethyl] pyridine-4-carboxylate Openeye Name: [2-oxo-2-[2-(4-oxo-2-thioxo-thiazolidin-3-yl)ethylamino]ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-oxo-2-[2-(4-oxo-2-sulfanylidene-3-thiazolidinyl)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)ethylamino]ethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-keto-2-[2-(4-keto-2-thioxo-thiazolidin-3-yl)ethylamino]ethyl] ester Formula: C13H13N3O4S2 MolecularWeight: 339.39002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=S)S1)CCNC(=O)COC(=O)C2=CC=NC=C2

Isomeric SMILES

C1C(=O)N(C(=S)S1)CCNC(=O)COC(=O)C2=CC=NC=C2

InChI

InChI=1S/C13H13N3O4S2/c17-10(7-20-12(19)9-1-3-14-4-2-9)15-5-6-16-11(18)8-22-13(16)21/h1-4H,5-8H2,(H,15,17)