(4-methylsulfanylphenyl)methyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetate CAS Name: 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetate Traditional Name: 2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetic acid [4-(methylthio)benzyl] ester Formula: C21H21NO5S3 MolecularWeight: 463.59014

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC(=O)OCC2=CC=C(C=C2)SC)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC(=O)OCC2=CC=C(C=C2)SC)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H21NO5S3/c1-22(30(24,25)21-4-3-13-29-21)17-7-9-18(10-8-17)26-15-20(23)27-14-16-5-11-19(28-2)12-6-16/h3-13H,14-15H2,1-2H3