dimethyl 3-methyl-5-[2-(3-methyl-5-nitro-pyrazol-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-(3-methyl-5-nitro-pyrazol-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(3-methyl-5-nitro-pyrazol-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(3-methyl-5-nitro-1-pyrazolyl)-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(3-methyl-5-nitropyrazol-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(3-methyl-5-nitro-pyrazol-1-yl)acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C15H16N4O7S MolecularWeight: 396.37514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)[N+](=O)[O-])CC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CC1=NN(C(=C1)[N+](=O)[O-])CC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C15H16N4O7S/c1-7-5-10(19(23)24)18(17-7)6-9(20)16-13-11(14(21)25-3)8(2)12(27-13)15(22)26-4/h5H,6H2,1-4H3,(H,16,20)