ethyl 4-[2-[3-(4-fluorophenyl)sulfanylpropanoyloxy]ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-[3-(4-fluorophenyl)sulfanylpropanoyloxy]ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-[3-(4-fluorophenyl)sulfanylpropanoyloxy]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[3-[(4-fluorophenyl)thio]-1-oxopropoxy]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-(4-fluorophenyl)sulfanylpropanoyloxy]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[3-[(4-fluorophenyl)thio]propanoyloxy]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H22FNO5S MolecularWeight: 407.455783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CCSC2=CC=C(C=C2)F)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CCSC2=CC=C(C=C2)F)C)C

InChI

InChI=1S/C20H22FNO5S/c1-4-26-20(25)19-13(3)22-12(2)18(19)16(23)11-27-17(24)9-10-28-15-7-5-14(21)6-8-15/h5-8,22H,4,9-11H2,1-3H3