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

Systemtic Name: ethyl 2-[2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyloxy]ethanoylamino]-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]oxyacetyl]amino]-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[2-[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethoxy]-1-oxoethyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]oxyacetyl]amino]-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-[[2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]oxyacetyl]amino]-4-(2-thienyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H20N4O7S2 MolecularWeight: 492.5254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)COC(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)COC(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C20H20N4O7S2/c1-4-30-20(27)17-13(14-6-5-7-32-14)10-33-19(17)21-15(25)9-31-16(26)8-23-12(3)18(24(28)29)11(2)22-23/h5-7,10H,4,8-9H2,1-3H3,(H,21,25)