ethyl 4-ethyl-5-methyl-2-[2-(6-methyl-2-nitro-pyridin-3-yl)oxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[2-(6-methyl-2-nitro-pyridin-3-yl)oxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[[2-[(6-methyl-2-nitro-3-pyridyl)oxy]acetyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[2-[(6-methyl-2-nitro-3-pyridinyl)oxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[[2-(6-methyl-2-nitropyridin-3-yl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[[2-[(6-methyl-2-nitro-3-pyridyl)oxy]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC2=C(N=C(C=C2)C)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC2=C(N=C(C=C2)C)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N3O6S/c1-5-12-11(4)28-17(15(12)18(23)26-6-2)20-14(22)9-27-13-8-7-10(3)19-16(13)21(24)25/h7-8H,5-6,9H2,1-4H3,(H,20,22)