11-[(5E)-5-[[(3-acetamidophenyl)amino]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid

Systemtic Name: 11-[(5E)-5-[[(3-acetamidophenyl)amino]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid Openeye Name: 11-[(5E)-5-[(3-acetamidoanilino)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]undecanoic acid CAS Name: 11-[(5E)-5-[(3-acetamidoanilino)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]undecanoic acid IUPAC Name: 11-[(5E)-5-[(3-acetamidoanilino)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid Traditional Name: 11-[(5E)-5-[(3-acetamidoanilino)methylene]-4-keto-2-thioxo-thiazolidin-3-yl]undecanoic acid Formula: C23H31N3O4S2 MolecularWeight: 477.63994

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC=C2C(=O)N(C(=S)S2)CCCCCCCCCCC(=O)O

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)N/C=C/2\C(=O)N(C(=S)S2)CCCCCCCCCCC(=O)O

InChI

InChI=1S/C23H31N3O4S2/c1-17(27)25-19-12-10-11-18(15-19)24-16-20-22(30)26(23(31)32-20)14-9-7-5-3-2-4-6-8-13-21(28)29/h10-12,15-16,24H,2-9,13-14H2,1H3,(H,25,27)(H,28,29)/b20-16+