[2,6-dimethoxy-4-(2-sulfanylethyl)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2,6-dimethoxy-4-(2-sulfanylethyl)phenyl] 4-methylbenzenesulfonate Openeye Name: [2,6-dimethoxy-4-(2-sulfanylethyl)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(2-mercaptoethyl)-2,6-dimethoxyphenyl] ester IUPAC Name: [2,6-dimethoxy-4-(2-sulfanylethyl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-(2-mercaptoethyl)-2,6-dimethoxy-phenyl] ester Formula: C17H20O5S2 MolecularWeight: 368.4677

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2OC)CCS)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2OC)CCS)OC

InChI

InChI=1S/C17H20O5S2/c1-12-4-6-14(7-5-12)24(18,19)22-17-15(20-2)10-13(8-9-23)11-16(17)21-3/h4-7,10-11,23H,8-9H2,1-3H3