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

Systemtic Name: ethyl 5-[3-(4-fluorophenyl)sulfonylpropanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[3-(4-fluorophenyl)sulfonylpropanoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[3-(4-fluorophenyl)sulfonyl-1-oxopropyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-fluorophenyl)sulfonylpropanoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[3-(4-fluorophenyl)sulfonylpropanoylamino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C17H18FNO5S2 MolecularWeight: 399.456923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C17H18FNO5S2/c1-3-24-17(21)16-11(2)10-15(25-16)19-14(20)8-9-26(22,23)13-6-4-12(18)5-7-13/h4-7,10H,3,8-9H2,1-2H3,(H,19,20)