2-[2-(4-bromophenyl)sulfanylethanoylamino]-5-chloranyl-benzoic acid

Systemtic Name: 2-[2-(4-bromophenyl)sulfanylethanoylamino]-5-chloranyl-benzoic acid Openeye Name: 2-[[2-(4-bromophenyl)sulfanylacetyl]amino]-5-chloro-benzoic acid CAS Name: 2-[[2-[(4-bromophenyl)thio]-1-oxoethyl]amino]-5-chlorobenzoic acid IUPAC Name: 2-[[2-(4-bromophenyl)sulfanylacetyl]amino]-5-chlorobenzoic acid Traditional Name: 2-[[2-[(4-bromophenyl)thio]acetyl]amino]-5-chloro-benzoic acid Formula: C15H11BrClNO3S MolecularWeight: 400.67474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCC(=O)NC2=C(C=C(C=C2)Cl)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1SCC(=O)NC2=C(C=C(C=C2)Cl)C(=O)O)Br

InChI

InChI=1S/C15H11BrClNO3S/c16-9-1-4-11(5-2-9)22-8-14(19)18-13-6-3-10(17)7-12(13)15(20)21/h1-7H,8H2,(H,18,19)(H,20,21)