methyl 2-[3-(5-bromanylthiophen-2-yl)sulfonylpropanoylamino]benzoate

Systemtic Name: methyl 2-[3-(5-bromanylthiophen-2-yl)sulfonylpropanoylamino]benzoate Openeye Name: methyl 2-[3-[(5-bromo-2-thienyl)sulfonyl]propanoylamino]benzoate CAS Name: 2-[[3-[(5-bromo-2-thiophenyl)sulfonyl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[3-(5-bromothiophen-2-yl)sulfonylpropanoylamino]benzoate Traditional Name: 2-[3-[(5-bromo-2-thienyl)sulfonyl]propanoylamino]benzoic acid methyl ester Formula: C15H14BrNO5S2 MolecularWeight: 432.30936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCS(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCS(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C15H14BrNO5S2/c1-22-15(19)10-4-2-3-5-11(10)17-13(18)8-9-24(20,21)14-7-6-12(16)23-14/h2-7H,8-9H2,1H3,(H,17,18)