[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2-methyl-5-sulfamoyl-benzoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2-methyl-5-sulfamoyl-benzoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 2-methyl-5-sulfamoyl-benzoate CAS Name: 2-methyl-5-sulfamoylbenzoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 2-methyl-5-sulfamoylbenzoate Traditional Name: 2-methyl-5-sulfamoyl-benzoic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C17H17NO5S2 MolecularWeight: 379.45058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)OCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)OCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C17H17NO5S2/c1-11-3-8-14(25(18,21)22)9-15(11)17(20)23-10-16(19)12-4-6-13(24-2)7-5-12/h3-9H,10H2,1-2H3,(H2,18,21,22)