dimethyl 2-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-[(3,4-dichlorophenyl)methylthio]-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-[(3,4-dichlorobenzyl)thio]acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C19H17Cl2NO5S MolecularWeight: 442.31298

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H17Cl2NO5S/c1-26-18(24)12-4-5-13(19(25)27-2)16(8-12)22-17(23)10-28-9-11-3-6-14(20)15(21)7-11/h3-8H,9-10H2,1-2H3,(H,22,23)