2-[5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid

Systemtic Name: 2-[5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Openeye Name: 2-[5-[[5-(3-nitrophenyl)-2-furyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid CAS Name: 2-[5-[[5-(3-nitrophenyl)-2-furanyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethanesulfonic acid IUPAC Name: 2-[5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Traditional Name: 2-[4-keto-5-[[5-(3-nitrophenyl)-2-furyl]methylene]-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid Formula: C16H12N2O7S3 MolecularWeight: 440.47068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)CCS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)CCS(=O)(=O)O

InChI

InChI=1S/C16H12N2O7S3/c19-15-14(27-16(26)17(15)6-7-28(22,23)24)9-12-4-5-13(25-12)10-2-1-3-11(8-10)18(20)21/h1-5,8-9H,6-7H2,(H,22,23,24)