2-(3-nitro-5-sulfamoyl-thiophen-2-yl)ethanethioic S-acid

Systemtic Name: 2-(3-nitro-5-sulfamoyl-thiophen-2-yl)ethanethioic S-acid Openeye Name: 2-(3-nitro-5-sulfamoyl-2-thienyl)ethanethioic S-acid CAS Name: 2-(3-nitro-5-sulfamoyl-2-thiophenyl)ethanethioic S-acid IUPAC Name: 2-(3-nitro-5-sulfamoylthiophen-2-yl)ethanethioic S-acid Traditional Name: 2-(3-nitro-5-sulfamoyl-2-thienyl)thioacetic acid Formula: C6H6N2O5S3 MolecularWeight: 282.31724

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1[N+](=O)[O-])CC(=O)S)S(=O)(=O)N

Isomeric SMILES

C1=C(SC(=C1[N+](=O)[O-])CC(=O)S)S(=O)(=O)N

InChI

InChI=1S/C6H6N2O5S3/c7-16(12,13)6-1-3(8(10)11)4(15-6)2-5(9)14/h1H,2H2,(H,9,14)(H2,7,12,13)