dimethyl 5-[2-(2-chlorophenyl)sulfanylethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(2-chlorophenyl)sulfanylethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(2-chlorophenyl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(2-chlorophenyl)thio]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(2-chlorophenyl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(2-chlorophenyl)thio]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H16ClNO5S MolecularWeight: 393.84134

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=CC=CC=C2Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=CC=CC=C2Cl)C(=O)OC

InChI

InChI=1S/C18H16ClNO5S/c1-24-17(22)11-7-12(18(23)25-2)9-13(8-11)20-16(21)10-26-15-6-4-3-5-14(15)19/h3-9H,10H2,1-2H3,(H,20,21)