5-bromanyl-2-[2-[(2-chlorophenyl)methylsulfanyl]ethanoylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-[(2-chlorophenyl)methylsulfanyl]ethanoylamino]benzoic acid Openeye Name: 5-bromo-2-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]benzoic acid CAS Name: 5-bromo-2-[[2-[(2-chlorophenyl)methylthio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[2-[(2-chlorobenzyl)thio]acetyl]amino]benzoic acid Formula: C16H13BrClNO3S MolecularWeight: 414.70132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrClNO3S/c17-11-5-6-14(12(7-11)16(21)22)19-15(20)9-23-8-10-3-1-2-4-13(10)18/h1-7H,8-9H2,(H,19,20)(H,21,22)