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

Systemtic Name: methyl 2-[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate Openeye Name: methyl 2-[(5E)-5-[(4-nitrophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetate CAS Name: 2-[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[(5E)-4-keto-5-(4-nitrobenzylidene)-2-thioxo-thiazolidin-3-yl]acetic acid methyl ester Formula: C13H10N2O5S2 MolecularWeight: 338.3589

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C(=CC2=CC=C(C=C2)[N+](=O)[O-])SC1=S

Isomeric SMILES

COC(=O)CN1C(=O)/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/SC1=S

InChI

InChI=1S/C13H10N2O5S2/c1-20-11(16)7-14-12(17)10(22-13(14)21)6-8-2-4-9(5-3-8)15(18)19/h2-6H,7H2,1H3/b10-6+