ethyl 2-[3-(4-fluorophenyl)sulfonylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-fluorophenyl)sulfonylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-fluorophenyl)sulfonylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-fluorophenyl)sulfonyl-1-oxopropyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-fluorophenyl)sulfonylpropanoylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[3-(4-fluorophenyl)sulfonylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H20FNO5S2 MolecularWeight: 413.483503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H20FNO5S2/c1-4-25-18(22)16-11(2)12(3)26-17(16)20-15(21)9-10-27(23,24)14-7-5-13(19)6-8-14/h5-8H,4,9-10H2,1-3H3,(H,20,21)