3-[(5E)-4-oxidanylidene-5-[(2-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 3-[(5E)-4-oxidanylidene-5-[(2-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[(5E)-4-oxo-5-[(2-prop-2-ynoxyphenyl)methylene]-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[(5E)-4-oxo-5-[(2-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[(5E)-4-oxo-5-[(2-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[(5E)-4-keto-5-(2-propargyloxybenzylidene)-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C16H13NO4S2 MolecularWeight: 347.40872

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC=C1C=C2C(=O)N(C(=S)S2)CCC(=O)O

Isomeric SMILES

C#CCOC1=CC=CC=C1/C=C/2\C(=O)N(C(=S)S2)CCC(=O)O

InChI

InChI=1S/C16H13NO4S2/c1-2-9-21-12-6-4-3-5-11(12)10-13-15(20)17(16(22)23-13)8-7-14(18)19/h1,3-6,10H,7-9H2,(H,18,19)/b13-10+