methyl 3-[(4-chlorophenyl)sulfonylamino]-2-(3-methyl-4-methylsulfanyl-phenoxy)propanoate

Systemtic Name: methyl 3-[(4-chlorophenyl)sulfonylamino]-2-(3-methyl-4-methylsulfanyl-phenoxy)propanoate Openeye Name: methyl 3-[(4-chlorophenyl)sulfonylamino]-2-(3-methyl-4-methylsulfanyl-phenoxy)propanoate CAS Name: 3-[(4-chlorophenyl)sulfonylamino]-2-[3-methyl-4-(methylthio)phenoxy]propanoic acid methyl ester IUPAC Name: methyl 3-[(4-chlorophenyl)sulfonylamino]-2-(3-methyl-4-methylsulfanylphenoxy)propanoate Traditional Name: 3-[(4-chlorophenyl)sulfonylamino]-2-[3-methyl-4-(methylthio)phenoxy]propionic acid methyl ester Formula: C18H20ClNO5S2 MolecularWeight: 429.9381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(CNS(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OC)SC

Isomeric SMILES

CC1=C(C=CC(=C1)OC(CNS(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OC)SC

InChI

InChI=1S/C18H20ClNO5S2/c1-12-10-14(6-9-17(12)26-3)25-16(18(21)24-2)11-20-27(22,23)15-7-4-13(19)5-8-15/h4-10,16,20H,11H2,1-3H3