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

Systemtic Name: dimethyl 3-methyl-5-[2-(4-nitropyrazol-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(4-nitropyrazol-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(4-nitropyrazol-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(4-nitropyrazol-1-yl)acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C14H14N4O7S MolecularWeight: 382.34856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C=C(C=N2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C=C(C=N2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H14N4O7S/c1-7-10(13(20)24-2)12(26-11(7)14(21)25-3)16-9(19)6-17-5-8(4-15-17)18(22)23/h4-5H,6H2,1-3H3,(H,16,19)