ethyl 2-[2-[(4-fluoranyl-3-nitro-phenyl)amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(4-fluoranyl-3-nitro-phenyl)amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-fluoro-3-nitro-anilino)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-(4-fluoro-3-nitroanilino)-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-fluoro-3-nitroanilino)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-fluoro-3-nitro-anilino)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H18FN3O5S MolecularWeight: 395.405323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CNC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CNC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H18FN3O5S/c1-4-26-17(23)15-9(2)10(3)27-16(15)20-14(22)8-19-11-5-6-12(18)13(7-11)21(24)25/h5-7,19H,4,8H2,1-3H3,(H,20,22)