3,4-bis(2-sulfanylethanoylamino)benzoic acid

Systemtic Name: 3,4-bis(2-sulfanylethanoylamino)benzoic acid Openeye Name: 3,4-bis[(2-sulfanylacetyl)amino]benzoic acid CAS Name: 3,4-bis[(2-mercapto-1-oxoethyl)amino]benzoic acid IUPAC Name: 3,4-bis[(2-sulfanylacetyl)amino]benzoic acid Traditional Name: 3,4-bis[(2-mercaptoacetyl)amino]benzoic acid Formula: C11H12N2O4S2 MolecularWeight: 300.35398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)CS)NC(=O)CS

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)CS)NC(=O)CS

InChI

InChI=1S/C11H12N2O4S2/c14-9(4-18)12-7-2-1-6(11(16)17)3-8(7)13-10(15)5-19/h1-3,18-19H,4-5H2,(H,12,14)(H,13,15)(H,16,17)