dimethyl 2-[[4-(phenylsulfanylmethyl)phenyl]carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[4-(phenylsulfanylmethyl)phenyl]carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[4-(phenylsulfanylmethyl)benzoyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[oxo-[4-[(phenylthio)methyl]phenyl]methyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[4-(phenylsulfanylmethyl)benzoyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[4-[(phenylthio)methyl]benzoyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C24H21NO5S MolecularWeight: 435.49224

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)CSC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)CSC3=CC=CC=C3

InChI

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