S-[[1-(2-fluorophenyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl] ethanethioate

Systemtic Name: S-[[1-(2-fluorophenyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl] ethanethioate Openeye Name: S-[[1-(2-fluorophenyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl] ethanethioate CAS Name: ethanethioic acid S-[[1-(2-fluorophenyl)-2-pyrrolyl]-(4-methoxyphenyl)methyl] ester IUPAC Name: S-[[1-(2-fluorophenyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl] ethanethioate Traditional Name: ethanethioic acid S-[[1-(2-fluorophenyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl] ester Formula: C20H18FNO2S MolecularWeight: 355.425823

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(C1=CC=C(C=C1)OC)C2=CC=CN2C3=CC=CC=C3F

Isomeric SMILES

CC(=O)SC(C1=CC=C(C=C1)OC)C2=CC=CN2C3=CC=CC=C3F

InChI

InChI=1S/C20H18FNO2S/c1-14(23)25-20(15-9-11-16(24-2)12-10-15)19-8-5-13-22(19)18-7-4-3-6-17(18)21/h3-13,20H,1-2H3