methyl 2-(5-bromanyl-2-formamido-thiophen-3-yl)sulfonylbenzoate

Systemtic Name: methyl 2-(5-bromanyl-2-formamido-thiophen-3-yl)sulfonylbenzoate Openeye Name: methyl 2-[(5-bromo-2-formamido-3-thienyl)sulfonyl]benzoate CAS Name: 2-[(5-bromo-2-formamido-3-thiophenyl)sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-(5-bromo-2-formamidothiophen-3-yl)sulfonylbenzoate Traditional Name: 2-[(5-bromo-2-formamido-3-thienyl)sulfonyl]benzoic acid methyl ester Formula: C13H10BrNO5S2 MolecularWeight: 404.2562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)C2=C(SC(=C2)Br)NC=O

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)C2=C(SC(=C2)Br)NC=O

InChI

InChI=1S/C13H10BrNO5S2/c1-20-13(17)8-4-2-3-5-9(8)22(18,19)10-6-11(14)21-12(10)15-7-16/h2-7H,1H3,(H,15,16)