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

Systemtic Name: ethyl 4,5-dimethyl-2-[(4-nitro-1H-pyrazol-5-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[(4-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[(4-nitro-1H-pyrazol-5-yl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[(4-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[(4-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C13H14N4O5S MolecularWeight: 338.33906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=C(C=NN2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=C(C=NN2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O5S/c1-4-22-13(19)9-6(2)7(3)23-12(9)15-11(18)10-8(17(20)21)5-14-16-10/h5H,4H2,1-3H3,(H,14,16)(H,15,18)