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

Systemtic Name: 3,4,5-triethoxy-N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]benzamide Openeye Name: 3,4,5-triethoxy-N-[(2-ethyl-4-iodo-phenyl)carbamothioyl]benzamide CAS Name: 3,4,5-triethoxy-N-[(2-ethyl-4-iodoanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[(2-ethyl-4-iodophenyl)carbamothioyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[(2-ethyl-4-iodo-phenyl)thiocarbamoyl]benzamide Formula: C22H27IN2O4S MolecularWeight: 542.43025

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27IN2O4S/c1-5-14-11-16(23)9-10-17(14)24-22(30)25-21(26)15-12-18(27-6-2)20(29-8-4)19(13-15)28-7-3/h9-13H,5-8H2,1-4H3,(H2,24,25,26,30)