2-[2-(3-bromophenyl)sulfanylethanoylamino]-4-chloranyl-benzoic acid

Systemtic Name: 2-[2-(3-bromophenyl)sulfanylethanoylamino]-4-chloranyl-benzoic acid Openeye Name: 2-[[2-(3-bromophenyl)sulfanylacetyl]amino]-4-chloro-benzoic acid CAS Name: 2-[[2-[(3-bromophenyl)thio]-1-oxoethyl]amino]-4-chlorobenzoic acid IUPAC Name: 2-[[2-(3-bromophenyl)sulfanylacetyl]amino]-4-chlorobenzoic acid Traditional Name: 2-[[2-[(3-bromophenyl)thio]acetyl]amino]-4-chloro-benzoic acid Formula: C15H11BrClNO3S MolecularWeight: 400.67474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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