dimethyl 5-[[2-(phenylmethylsulfanyl)phenyl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[2-(phenylmethylsulfanyl)phenyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(2-benzylsulfanylbenzoyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[2-(phenylmethylthio)phenyl]methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2-benzylsulfanylbenzoyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(benzylthio)benzoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C24H21NO5S MolecularWeight: 435.49224

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H21NO5S/c1-29-23(27)17-12-18(24(28)30-2)14-19(13-17)25-22(26)20-10-6-7-11-21(20)31-15-16-8-4-3-5-9-16/h3-14H,15H2,1-2H3,(H,25,26)