ethyl 3-[2-(4-bromophenyl)sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-(4-bromophenyl)sulfanylethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(4-bromophenyl)sulfanylacetyl]amino]benzoate CAS Name: 3-[[2-[(4-bromophenyl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-bromophenyl)sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[(4-bromophenyl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C17H16BrNO3S MolecularWeight: 394.28284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H16BrNO3S/c1-2-22-17(21)12-4-3-5-14(10-12)19-16(20)11-23-15-8-6-13(18)7-9-15/h3-10H,2,11H2,1H3,(H,19,20)