(4-methylsulfanylphenyl)methyl 2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-(2-methyl-N-methylsulfonyl-anilino)acetate CAS Name: 2-(2-methyl-N-methylsulfonylanilino)acetic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-(2-methyl-N-methylsulfonylanilino)acetate Traditional Name: 2-(N-mesyl-2-methyl-anilino)acetic acid [4-(methylthio)benzyl] ester Formula: C18H21NO4S2 MolecularWeight: 379.49364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)OCC2=CC=C(C=C2)SC)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)OCC2=CC=C(C=C2)SC)S(=O)(=O)C

InChI

InChI=1S/C18H21NO4S2/c1-14-6-4-5-7-17(14)19(25(3,21)22)12-18(20)23-13-15-8-10-16(24-2)11-9-15/h4-11H,12-13H2,1-3H3