5-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: 5-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: 5-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(3-chlorophenyl)methylthio]-1-oxoethyl]amino]benzene-1,3-dicarboxylate IUPAC Name: 5-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(3-chlorobenzyl)thio]acetyl]amino]isophthalate Formula: C17H12ClNO5S-2 MolecularWeight: 377.79888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CSCC(=O)NC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CSCC(=O)NC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H14ClNO5S/c18-13-3-1-2-10(4-13)8-25-9-15(20)19-14-6-11(16(21)22)5-12(7-14)17(23)24/h1-7H,8-9H2,(H,19,20)(H,21,22)(H,23,24)/p-2