[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]acetic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 2-[(4-chlorophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C18H18ClNO5S2 MolecularWeight: 427.92222

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC(=O)C1=CC=C(C=C1)SC)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN(CC(=O)OCC(=O)C1=CC=C(C=C1)SC)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H18ClNO5S2/c1-20(27(23,24)16-9-5-14(19)6-10-16)11-18(22)25-12-17(21)13-3-7-15(26-2)8-4-13/h3-10H,11-12H2,1-2H3