3-[(5E)-4-oxidanylidene-5-[(5-phenanthren-9-ylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 3-[(5E)-4-oxidanylidene-5-[(5-phenanthren-9-ylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[(5E)-4-oxo-5-[[5-(9-phenanthryl)-2-furyl]methylene]-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[(5E)-4-oxo-5-[[5-(9-phenanthrenyl)-2-furanyl]methylidene]-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[(5E)-4-oxo-5-[(5-phenanthren-9-ylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[(5E)-4-keto-5-[[5-(9-phenanthryl)-2-furyl]methylene]-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C25H17NO4S2 MolecularWeight: 459.53678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C4=CC=C(O4)C=C5C(=O)N(C(=S)S5)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C4=CC=C(O4)/C=C/5\C(=O)N(C(=S)S5)CCC(=O)O

InChI

InChI=1S/C25H17NO4S2/c27-23(28)11-12-26-24(29)22(32-25(26)31)14-16-9-10-21(30-16)20-13-15-5-1-2-6-17(15)18-7-3-4-8-19(18)20/h1-10,13-14H,11-12H2,(H,27,28)/b22-14+