methyl 2-[2-(4-bromophenyl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 2-[2-(4-bromophenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 2-[[2-(4-bromophenyl)sulfanylacetyl]amino]benzoate CAS Name: 2-[[2-[(4-bromophenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-bromophenyl)sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[(4-bromophenyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C16H14BrNO3S MolecularWeight: 380.25626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H14BrNO3S/c1-21-16(20)13-4-2-3-5-14(13)18-15(19)10-22-12-8-6-11(17)7-9-12/h2-9H,10H2,1H3,(H,18,19)