6-[2-[(5Z)-4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoylamino]hexanoic acid

Systemtic Name: 6-[2-[(5Z)-4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoylamino]hexanoic acid Openeye Name: 6-[[2-[(5Z)-5-benzylidene-4-oxo-2-thioxo-thiazolidin-3-yl]acetyl]amino]hexanoic acid CAS Name: 6-[[1-oxo-2-[(5Z)-4-oxo-5-(phenylmethylene)-2-sulfanylidene-3-thiazolidinyl]ethyl]amino]hexanoic acid IUPAC Name: 6-[[2-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]amino]hexanoic acid Traditional Name: 6-[[2-[(5Z)-5-benzal-4-keto-2-thioxo-thiazolidin-3-yl]acetyl]amino]hexanoic acid Formula: C18H20N2O4S2 MolecularWeight: 392.4924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)NCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CC(=O)NCCCCCC(=O)O

InChI

InChI=1S/C18H20N2O4S2/c21-15(19-10-6-2-5-9-16(22)23)12-20-17(24)14(26-18(20)25)11-13-7-3-1-4-8-13/h1,3-4,7-8,11H,2,5-6,9-10,12H2,(H,19,21)(H,22,23)/b14-11-