ethyl 5-aminocarbonyl-2-[[4,5-bis(bromanyl)-1H-pyrazol-3-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-2-[[4,5-bis(bromanyl)-1H-pyrazol-3-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-2-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[(4,5-dibromo-1H-pyrazol-3-yl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-2-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C13H12Br2N4O4S MolecularWeight: 480.13178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=NNC(=C2Br)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=NNC(=C2Br)Br

InChI

InChI=1S/C13H12Br2N4O4S/c1-3-23-13(22)5-4(2)8(10(16)20)24-12(5)17-11(21)7-6(14)9(15)19-18-7/h3H2,1-2H3,(H2,16,20)(H,17,21)(H,18,19)