[5-(4-fluorophenyl)sulfanyl-1H-pyrrol-3-yl]methyl methanesulfonate

Systemtic Name: [5-(4-fluorophenyl)sulfanyl-1H-pyrrol-3-yl]methyl methanesulfonate Openeye Name: [5-(4-fluorophenyl)sulfanyl-1H-pyrrol-3-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [5-[(4-fluorophenyl)thio]-1H-pyrrol-3-yl]methyl ester IUPAC Name: [5-(4-fluorophenyl)sulfanyl-1H-pyrrol-3-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [5-[(4-fluorophenyl)thio]-1H-pyrrol-3-yl]methyl ester Formula: C12H12FNO3S2 MolecularWeight: 301.356983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1=CNC(=C1)SC2=CC=C(C=C2)F

Isomeric SMILES

CS(=O)(=O)OCC1=CNC(=C1)SC2=CC=C(C=C2)F

InChI

InChI=1S/C12H12FNO3S2/c1-19(15,16)17-8-9-6-12(14-7-9)18-11-4-2-10(13)3-5-11/h2-7,14H,8H2,1H3