(4-methylsulfanylphenyl)methyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate

Systemtic Name: (4-methylsulfanylphenyl)methyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate Openeye Name: (4-methylsulfanylphenyl)methyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]-2-propenoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]acrylic acid [4-(methylthio)benzyl] ester Formula: C19H21NO5S2 MolecularWeight: 407.50374

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=CC(=C1)C=CC(=O)OCC2=CC=C(C=C2)SC)OC

Isomeric SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)/C=C/C(=O)OCC2=CC=C(C=C2)SC)OC

InChI

InChI=1S/C19H21NO5S2/c1-20-27(22,23)18-12-14(6-10-17(18)24-2)7-11-19(21)25-13-15-4-8-16(26-3)9-5-15/h4-12,20H,13H2,1-3H3/b11-7+