3-[(5E)-5-[[5-(3-nitrophenyl)thiophen-2-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: 3-[(5E)-5-[[5-(3-nitrophenyl)thiophen-2-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: 3-[(5E)-5-[[5-(3-nitrophenyl)-2-thienyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoate CAS Name: 3-[(5E)-5-[[5-(3-nitrophenyl)-2-thiophenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoate IUPAC Name: 3-[(5E)-5-[[5-(3-nitrophenyl)thiophen-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[(5E)-4-keto-5-[[5-(3-nitrophenyl)-2-thienyl]methylene]-2-thioxo-thiazolidin-3-yl]propionate Formula: C17H11N2O5S3- MolecularWeight: 419.47464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(S2)C=C3C(=O)N(C(=S)S3)CCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(S2)/C=C/3\C(=O)N(C(=S)S3)CCC(=O)[O-]

InChI

InChI=1S/C17H12N2O5S3/c20-15(21)6-7-18-16(22)14(27-17(18)25)9-12-4-5-13(26-12)10-2-1-3-11(8-10)19(23)24/h1-5,8-9H,6-7H2,(H,20,21)/p-1/b14-9+