diethyl 5-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[4-(1,3-dithian-2-yl)benzoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[4-(1,3-dithian-2-yl)phenyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[4-(1,3-dithian-2-yl)benzoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-(1,3-dithian-2-yl)benzoyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C23H25NO5S2 MolecularWeight: 459.5783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)C3SCCCS3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)C3SCCCS3)C(=O)OCC

InChI

InChI=1S/C23H25NO5S2/c1-3-28-21(26)17-12-18(22(27)29-4-2)14-19(13-17)24-20(25)15-6-8-16(9-7-15)23-30-10-5-11-31-23/h6-9,12-14,23H,3-5,10-11H2,1-2H3,(H,24,25)