(4-methylsulfanylphenyl)methyl 3-[(3-ethanoylphenyl)sulfonylamino]propanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-[(3-ethanoylphenyl)sulfonylamino]propanoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-[(3-acetylphenyl)sulfonylamino]propanoate CAS Name: 3-[(3-acetylphenyl)sulfonylamino]propanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-[(3-acetylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(3-acetylphenyl)sulfonylamino]propionic acid [4-(methylthio)benzyl] ester Formula: C19H21NO5S2 MolecularWeight: 407.50374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO5S2/c1-14(21)16-4-3-5-18(12-16)27(23,24)20-11-10-19(22)25-13-15-6-8-17(26-2)9-7-15/h3-9,12,20H,10-11,13H2,1-2H3