(4-methylsulfanylphenyl)methyl 3-(dimethylsulfamoyl)-4-methoxy-benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-(dimethylsulfamoyl)-4-methoxy-benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-(dimethylsulfamoyl)-4-methoxy-benzoate CAS Name: 3-(dimethylsulfamoyl)-4-methoxybenzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-(dimethylsulfamoyl)-4-methoxybenzoate Traditional Name: 3-(dimethylsulfamoyl)-4-methoxy-benzoic acid [4-(methylthio)benzyl] ester Formula: C18H21NO5S2 MolecularWeight: 395.49304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=CC=C(C=C2)SC)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=CC=C(C=C2)SC)OC

InChI

InChI=1S/C18H21NO5S2/c1-19(2)26(21,22)17-11-14(7-10-16(17)23-3)18(20)24-12-13-5-8-15(25-4)9-6-13/h5-11H,12H2,1-4H3