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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=C(C=C(C(=C2)C)C)O

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=C(C=C(C(=C2)C)C)O

InChI

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