4-[2-(3-acetamidophenyl)sulfanylethanoylamino]benzoic acid

Systemtic Name: 4-[2-(3-acetamidophenyl)sulfanylethanoylamino]benzoic acid Openeye Name: 4-[[2-(3-acetamidophenyl)sulfanylacetyl]amino]benzoic acid CAS Name: 4-[[2-[(3-acetamidophenyl)thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-(3-acetamidophenyl)sulfanylacetyl]amino]benzoic acid Traditional Name: 4-[[2-[(3-acetamidophenyl)thio]acetyl]amino]benzoic acid Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)SCC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)SCC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C17H16N2O4S/c1-11(20)18-14-3-2-4-15(9-14)24-10-16(21)19-13-7-5-12(6-8-13)17(22)23/h2-9H,10H2,1H3,(H,18,20)(H,19,21)(H,22,23)