5-[(5-bromanylthiophen-3-yl)carbonylamino]-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[(5-bromanylthiophen-3-yl)carbonylamino]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[(5-bromothiophene-3-carbonyl)amino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[(5-bromo-3-thiophenyl)-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(5-bromothiophene-3-carbonyl)amino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[(5-bromothiophene-3-carbonyl)amino]-3-methyl-2-thenoic acid Formula: C11H8BrNO3S2 MolecularWeight: 346.22012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=CSC(=C2)Br)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=CSC(=C2)Br)C(=O)O

InChI

InChI=1S/C11H8BrNO3S2/c1-5-2-8(18-9(5)11(15)16)13-10(14)6-3-7(12)17-4-6/h2-4H,1H3,(H,13,14)(H,15,16)