3,4,5-triethoxy-N-[(5-ethyl-2-oxidanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 3,4,5-triethoxy-N-[(5-ethyl-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: 3,4,5-triethoxy-N-[(5-ethyl-2-hydroxy-phenyl)carbamothioyl]benzamide CAS Name: 3,4,5-triethoxy-N-[(5-ethyl-2-hydroxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[(5-ethyl-2-hydroxyphenyl)carbamothioyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[(5-ethyl-2-hydroxy-phenyl)thiocarbamoyl]benzamide Formula: C22H28N2O5S MolecularWeight: 432.53312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC(=C(C(=C2)OCC)OCC)OCC

Isomeric SMILES

CCC1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC(=C(C(=C2)OCC)OCC)OCC

InChI

InChI=1S/C22H28N2O5S/c1-5-14-9-10-17(25)16(11-14)23-22(30)24-21(26)15-12-18(27-6-2)20(29-8-4)19(13-15)28-7-3/h9-13,25H,5-8H2,1-4H3,(H2,23,24,26,30)