(4-methylsulfanylphenyl)methyl 2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-fluorophenyl)sulfonyl-methylamino]acetic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-[(4-fluorophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetic acid [4-(methylthio)benzyl] ester Formula: C17H18FNO4S2 MolecularWeight: 383.457523

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC1=CC=C(C=C1)SC)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CN(CC(=O)OCC1=CC=C(C=C1)SC)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H18FNO4S2/c1-19(25(21,22)16-9-5-14(18)6-10-16)11-17(20)23-12-13-3-7-15(24-2)8-4-13/h3-10H,11-12H2,1-2H3