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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC(=CC(=C2O)C)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC(=CC(=C2O)C)C

InChI

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