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

Systemtic Name: ethyl 4-cyclopropyl-2-[2-[(4-fluoranyl-3-nitro-phenyl)amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-cyclopropyl-2-[[2-(4-fluoro-3-nitro-anilino)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-cyclopropyl-2-[[2-(4-fluoro-3-nitroanilino)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyclopropyl-2-[[2-(4-fluoro-3-nitroanilino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-cyclopropyl-2-[[2-(4-fluoro-3-nitro-anilino)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H18FN3O5S MolecularWeight: 407.416023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CNC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CNC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18FN3O5S/c1-2-27-18(24)16-12(10-3-4-10)9-28-17(16)21-15(23)8-20-11-5-6-13(19)14(7-11)22(25)26/h5-7,9-10,20H,2-4,8H2,1H3,(H,21,23)