(4-methylsulfanylphenyl)methyl 3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-[[(E)-2-(p-tolyl)vinyl]sulfonylamino]propanoate CAS Name: 3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanoate Traditional Name: 3-[[(E)-2-(p-tolyl)vinyl]sulfonylamino]propionic acid [4-(methylthio)benzyl] ester Formula: C20H23NO4S2 MolecularWeight: 405.53092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CS(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)SC

InChI

InChI=1S/C20H23NO4S2/c1-16-3-5-17(6-4-16)12-14-27(23,24)21-13-11-20(22)25-15-18-7-9-19(26-2)10-8-18/h3-10,12,14,21H,11,13,15H2,1-2H3/b14-12+