2-[2-[(2-bromophenyl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: 2-[2-[(2-bromophenyl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: 2-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 2-[[2-[(2-bromophenyl)methylthio]-1-oxoethyl]amino]benzoate IUPAC Name: 2-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 2-[[2-[(2-bromobenzyl)thio]acetyl]amino]benzoate Formula: C16H13BrNO3S- MolecularWeight: 379.24832

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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)/p-1