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

Systemtic Name: 5-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(4-bromo-1-methylpyrrole-2-carbonyl)amino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]-3-methyl-2-thenoic acid Formula: C12H11BrN2O3S MolecularWeight: 343.19634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=CC(=CN2C)Br)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=CC(=CN2C)Br)C(=O)O

InChI

InChI=1S/C12H11BrN2O3S/c1-6-3-9(19-10(6)12(17)18)14-11(16)8-4-7(13)5-15(8)2/h3-5H,1-2H3,(H,14,16)(H,17,18)