5-[(4-bromanyl-1-ethyl-pyrrol-2-yl)carbonylamino]-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[(4-bromanyl-1-ethyl-pyrrol-2-yl)carbonylamino]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[(4-bromo-1-ethyl-pyrrole-2-carbonyl)amino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[(4-bromo-1-ethyl-2-pyrrolyl)-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(4-bromo-1-ethylpyrrole-2-carbonyl)amino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[(4-bromo-1-ethyl-pyrrole-2-carbonyl)amino]-3-methyl-2-thenoic acid Formula: C13H13BrN2O3S MolecularWeight: 357.22292

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C(=O)NC2=CC(=C(S2)C(=O)O)C)Br

Isomeric SMILES

CCN1C=C(C=C1C(=O)NC2=CC(=C(S2)C(=O)O)C)Br

InChI

InChI=1S/C13H13BrN2O3S/c1-3-16-6-8(14)5-9(16)12(17)15-10-4-7(2)11(20-10)13(18)19/h4-6H,3H2,1-2H3,(H,15,17)(H,18,19)