N-[(5Z)-5-[[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]thiophene-2-carboxamide

Systemtic Name: N-[(5Z)-5-[[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]thiophene-2-carboxamide Openeye Name: N-[(5Z)-5-[[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]thiophene-2-carboxamide CAS Name: N-[(5Z)-5-[[4-(2-hydroxyethylthio)-3-nitrophenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-2-thiophenecarboxamide IUPAC Name: N-[(5Z)-5-[[4-(2-hydroxyethylsulfanyl)-3-nitrophenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]thiophene-2-carboxamide Traditional Name: N-[(5Z)-5-[4-(2-hydroxyethylthio)-3-nitro-benzylidene]-4-keto-2-thioxo-thiazolidin-3-yl]thiophene-2-carboxamide Formula: C17H13N3O5S4 MolecularWeight: 467.56222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NN2C(=O)C(=CC3=CC(=C(C=C3)SCCO)[N+](=O)[O-])SC2=S

Isomeric SMILES

C1=CSC(=C1)C(=O)NN2C(=O)/C(=C/C3=CC(=C(C=C3)SCCO)[N+](=O)[O-])/SC2=S

InChI

InChI=1S/C17H13N3O5S4/c21-5-7-28-12-4-3-10(8-11(12)20(24)25)9-14-16(23)19(17(26)29-14)18-15(22)13-2-1-6-27-13/h1-4,6,8-9,21H,5,7H2,(H,18,22)/b14-9-