O2-ethyl O4-[2-(2-fluorophenyl)sulfanylethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-[2-(2-fluorophenyl)sulfanylethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-ethyl O4-[2-(2-fluorophenyl)sulfanylethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-[2-[(2-fluorophenyl)thio]ethyl] ester IUPAC Name: 2-O-ethyl 4-O-[2-(2-fluorophenyl)sulfanylethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-[2-[(2-fluorophenyl)thio]ethyl] ester Formula: C18H20FNO4S MolecularWeight: 365.419103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCCSC2=CC=CC=C2F)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCCSC2=CC=CC=C2F)C

InChI

InChI=1S/C18H20FNO4S/c1-4-23-18(22)16-11(2)15(12(3)20-16)17(21)24-9-10-25-14-8-6-5-7-13(14)19/h5-8,20H,4,9-10H2,1-3H3