diethyl 3-methyl-5-[(2-methyl-5-nitro-pyrazol-3-yl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[(2-methyl-5-nitro-pyrazol-3-yl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[(2-methyl-5-nitro-pyrazole-3-carbonyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(2-methyl-5-nitro-3-pyrazolyl)-oxomethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(2-methyl-5-nitropyrazole-3-carbonyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(2-methyl-5-nitro-pyrazole-3-carbonyl)amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C16H18N4O7S MolecularWeight: 410.40172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=NN2C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=NN2C)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O7S/c1-5-26-15(22)11-8(3)12(16(23)27-6-2)28-14(11)17-13(21)9-7-10(20(24)25)18-19(9)4/h7H,5-6H2,1-4H3,(H,17,21)