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

Systemtic Name: ethyl 4,5-dimethyl-2-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[2-(5-methyl-3-nitro-pyrazol-1-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[2-(5-methyl-3-nitro-1-pyrazolyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-(5-methyl-3-nitro-pyrazol-1-yl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C15H18N4O5S MolecularWeight: 366.39222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C15H18N4O5S/c1-5-24-15(21)13-9(3)10(4)25-14(13)16-12(20)7-18-8(2)6-11(17-18)19(22)23/h6H,5,7H2,1-4H3,(H,16,20)