ethyl 4-[6-(5-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)hexanoylamino]benzoate

Systemtic Name: ethyl 4-[6-(5-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)hexanoylamino]benzoate Openeye Name: ethyl 4-[6-(5-ethyl-4-oxo-2-thioxo-thiazolidin-3-yl)hexanoylamino]benzoate CAS Name: 4-[[6-(5-ethyl-4-oxo-2-sulfanylidene-3-thiazolidinyl)-1-oxohexyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[6-(5-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)hexanoylamino]benzoate Traditional Name: 4-[6-(5-ethyl-4-keto-2-thioxo-thiazolidin-3-yl)hexanoylamino]benzoic acid ethyl ester Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C(=S)S1)CCCCCC(=O)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCC1C(=O)N(C(=S)S1)CCCCCC(=O)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C20H26N2O4S2/c1-3-16-18(24)22(20(27)28-16)13-7-5-6-8-17(23)21-15-11-9-14(10-12-15)19(25)26-4-2/h9-12,16H,3-8,13H2,1-2H3,(H,21,23)