5-bromanyl-2-[2-[(4-chlorophenyl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: 5-bromanyl-2-[2-[(4-chlorophenyl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: 5-bromo-2-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 5-bromo-2-[[2-[(4-chlorophenyl)methylthio]-1-oxoethyl]amino]benzoate IUPAC Name: 5-bromo-2-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 5-bromo-2-[[2-[(4-chlorobenzyl)thio]acetyl]amino]benzoate Formula: C16H12BrClNO3S- MolecularWeight: 413.69338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCC(=O)NC2=C(C=C(C=C2)Br)C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CSCC(=O)NC2=C(C=C(C=C2)Br)C(=O)[O-])Cl

InChI

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