2-[2-[(2-bromophenyl)methylsulfanyl]ethanoylamino]benzoic acid

Systemtic Name: 2-[2-[(2-bromophenyl)methylsulfanyl]ethanoylamino]benzoic acid Openeye Name: 2-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]benzoic acid CAS Name: 2-[[2-[(2-bromophenyl)methylthio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]benzoic acid Traditional Name: 2-[[2-[(2-bromobenzyl)thio]acetyl]amino]benzoic acid Formula: C16H14BrNO3S MolecularWeight: 380.25626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC(=O)NC2=CC=CC=C2C(=O)O)Br

Isomeric SMILES

C1=CC=C(C(=C1)CSCC(=O)NC2=CC=CC=C2C(=O)O)Br

InChI

InChI=1S/C16H14BrNO3S/c17-13-7-3-1-5-11(13)9-22-10-15(19)18-14-8-4-2-6-12(14)16(20)21/h1-8H,9-10H2,(H,18,19)(H,20,21)