diethyl 5-[2-(4-chlorophenyl)sulfanylethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[2-(4-chlorophenyl)sulfanylethanoylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[2-(4-chlorophenyl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(4-chlorophenyl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(4-chlorophenyl)thio]acetyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C20H20ClNO5S MolecularWeight: 421.8945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=CC=C(C=C2)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=CC=C(C=C2)Cl)C(=O)OCC

InChI

InChI=1S/C20H20ClNO5S/c1-3-26-19(24)13-9-14(20(25)27-4-2)11-16(10-13)22-18(23)12-28-17-7-5-15(21)6-8-17/h5-11H,3-4,12H2,1-2H3,(H,22,23)