3-(5-methylsulfanyl-2-nitro-phenyl)carbonyl-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(5-methylsulfanyl-2-nitro-phenyl)carbonyl-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(5-methylsulfanyl-2-nitro-benzoyl)thiazolidine-4-carboxylic acid CAS Name: 3-[[5-(methylthio)-2-nitrophenyl]-oxomethyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-(5-methylsulfanyl-2-nitrobenzoyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[5-(methylthio)-2-nitro-benzoyl]thiazolidine-4-carboxylic acid Formula: C12H12N2O5S2 MolecularWeight: 328.36408

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)N2CSCC2C(=O)O

Isomeric SMILES

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)N2CSCC2C(=O)O

InChI

InChI=1S/C12H12N2O5S2/c1-20-7-2-3-9(14(18)19)8(4-7)11(15)13-6-21-5-10(13)12(16)17/h2-4,10H,5-6H2,1H3,(H,16,17)