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

Systemtic Name: [5-(4-methoxyphenyl)sulfanyl-1H-pyrrol-3-yl]methyl methanesulfonate Openeye Name: [5-(4-methoxyphenyl)sulfanyl-1H-pyrrol-3-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [5-[(4-methoxyphenyl)thio]-1H-pyrrol-3-yl]methyl ester IUPAC Name: [5-(4-methoxyphenyl)sulfanyl-1H-pyrrol-3-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [5-[(4-methoxyphenyl)thio]-1H-pyrrol-3-yl]methyl ester Formula: C13H15NO4S2 MolecularWeight: 313.3925

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=CC(=CN2)COS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)SC2=CC(=CN2)COS(=O)(=O)C

InChI

InChI=1S/C13H15NO4S2/c1-17-11-3-5-12(6-4-11)19-13-7-10(8-14-13)9-18-20(2,15)16/h3-8,14H,9H2,1-2H3