dimethyl 5-[[4,5-bis(bromanyl)-1H-pyrazol-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[[4,5-bis(bromanyl)-1H-pyrazol-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(4,5-dibromo-1H-pyrazol-3-yl)-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C13H11Br2N3O5S MolecularWeight: 481.11654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=NNC(=C2Br)Br)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=NNC(=C2Br)Br)C(=O)OC

InChI

InChI=1S/C13H11Br2N3O5S/c1-4-5(12(20)22-2)11(24-8(4)13(21)23-3)16-10(19)7-6(14)9(15)18-17-7/h1-3H3,(H,16,19)(H,17,18)