2-[(5E)-5-[[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate

Systemtic Name: 2-[(5E)-5-[[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate Openeye Name: 2-[(5E)-5-[[3-nitro-4-(p-tolylsulfanyl)phenyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetate CAS Name: 2-[(5E)-5-[[4-[(4-methylphenyl)thio]-3-nitrophenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetate IUPAC Name: 2-[(5E)-5-[[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[(5E)-4-keto-5-[3-nitro-4-(p-tolylthio)benzylidene]-2-thioxo-thiazolidin-3-yl]acetate Formula: C19H13N2O5S3- MolecularWeight: 445.51192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)/C=C/3\C(=O)N(C(=S)S3)CC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H14N2O5S3/c1-11-2-5-13(6-3-11)28-15-7-4-12(8-14(15)21(25)26)9-16-18(24)20(10-17(22)23)19(27)29-16/h2-9H,10H2,1H3,(H,22,23)/p-1/b16-9+