methyl 4-[(5Z)-5-[(4-chloranyl-3-nitro-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate

Systemtic Name: methyl 4-[(5Z)-5-[(4-chloranyl-3-nitro-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate Openeye Name: methyl 4-[(5Z)-5-[(4-chloro-3-nitro-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzoate CAS Name: 4-[(5Z)-5-[(4-chloro-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5Z)-5-[(4-chloro-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate Traditional Name: 4-[(5Z)-5-(4-chloro-3-nitro-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]benzoic acid methyl ester Formula: C18H11ClN2O5S2 MolecularWeight: 434.87334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])SC2=S

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-])/SC2=S

InChI

InChI=1S/C18H11ClN2O5S2/c1-26-17(23)11-3-5-12(6-4-11)20-16(22)15(28-18(20)27)9-10-2-7-13(19)14(8-10)21(24)25/h2-9H,1H3/b15-9-