2-[2-(4-aminophenyl)sulfanylethanoylamino]-4-chloranyl-benzoic acid

Systemtic Name: 2-[2-(4-aminophenyl)sulfanylethanoylamino]-4-chloranyl-benzoic acid Openeye Name: 2-[[2-(4-aminophenyl)sulfanylacetyl]amino]-4-chloro-benzoic acid CAS Name: 2-[[2-[(4-aminophenyl)thio]-1-oxoethyl]amino]-4-chlorobenzoic acid IUPAC Name: 2-[[2-(4-aminophenyl)sulfanylacetyl]amino]-4-chlorobenzoic acid Traditional Name: 2-[[2-[(4-aminophenyl)thio]acetyl]amino]-4-chloro-benzoic acid Formula: C15H13ClN2O3S MolecularWeight: 336.79332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)SCC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1N)SCC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C15H13ClN2O3S/c16-9-1-6-12(15(20)21)13(7-9)18-14(19)8-22-11-4-2-10(17)3-5-11/h1-7H,8,17H2,(H,18,19)(H,20,21)