11-[2-[(5E)-4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoylamino]undecanoic acid

Systemtic Name: 11-[2-[(5E)-4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoylamino]undecanoic acid Openeye Name: 11-[[2-[(5E)-5-benzylidene-4-oxo-2-thioxo-thiazolidin-3-yl]acetyl]amino]undecanoic acid CAS Name: 11-[[1-oxo-2-[(5E)-4-oxo-5-(phenylmethylene)-2-sulfanylidene-3-thiazolidinyl]ethyl]amino]undecanoic acid IUPAC Name: 11-[[2-[(5E)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]amino]undecanoic acid Traditional Name: 11-[[2-[(5E)-5-benzal-4-keto-2-thioxo-thiazolidin-3-yl]acetyl]amino]undecanoic acid Formula: C23H30N2O4S2 MolecularWeight: 462.6253

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O4S2/c26-20(24-15-11-6-4-2-1-3-5-10-14-21(27)28)17-25-22(29)19(31-23(25)30)16-18-12-8-7-9-13-18/h7-9,12-13,16H,1-6,10-11,14-15,17H2,(H,24,26)(H,27,28)/b19-16+