3-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]thiophene-2-carboxylic acid CAS Name: 3-[[2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-1-oxoethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-[[2-[(5-bromo-2-furoyl)amino]acetyl]amino]-2-thenoic acid Formula: C12H9BrN2O5S MolecularWeight: 373.17926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1NC(=O)CNC(=O)C2=CC=C(O2)Br)C(=O)O

Isomeric SMILES

C1=CSC(=C1NC(=O)CNC(=O)C2=CC=C(O2)Br)C(=O)O

InChI

InChI=1S/C12H9BrN2O5S/c13-8-2-1-7(20-8)11(17)14-5-9(16)15-6-3-4-21-10(6)12(18)19/h1-4H,5H2,(H,14,17)(H,15,16)(H,18,19)