ethyl 2-[2-[(4-bromophenyl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[(4-bromophenyl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[(4-bromophenyl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 2-[[2-[(4-bromophenyl)methylthio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4-bromophenyl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 2-[[2-[(4-bromobenzyl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CSCC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CSCC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrNO3S/c1-2-23-18(22)15-5-3-4-6-16(15)20-17(21)12-24-11-13-7-9-14(19)10-8-13/h3-10H,2,11-12H2,1H3,(H,20,21)