4-methyl-2-[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid

Systemtic Name: 4-methyl-2-[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Openeye Name: 4-methyl-2-[(5Z)-5-[(2-nitrophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]pentanoic acid CAS Name: 4-methyl-2-[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]pentanoic acid IUPAC Name: 4-methyl-2-[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Traditional Name: 2-[(5Z)-4-keto-5-(2-nitrobenzylidene)-2-thioxo-thiazolidin-3-yl]-4-methyl-valeric acid Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N1C(=O)C(=CC2=CC=CC=C2[N+](=O)[O-])SC1=S

Isomeric SMILES

CC(C)CC(C(=O)O)N1C(=O)/C(=C/C2=CC=CC=C2[N+](=O)[O-])/SC1=S

InChI

InChI=1S/C16H16N2O5S2/c1-9(2)7-12(15(20)21)17-14(19)13(25-16(17)24)8-10-5-3-4-6-11(10)18(22)23/h3-6,8-9,12H,7H2,1-2H3,(H,20,21)/b13-8-