2-iodanyl-N-[[3-(2-phenoxyethoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-iodanyl-N-[[3-(2-phenoxyethoxy)phenyl]carbamothioyl]benzamide Openeye Name: 2-iodo-N-[[3-(2-phenoxyethoxy)phenyl]carbamothioyl]benzamide CAS Name: 2-iodo-N-[[3-(2-phenoxyethoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-iodo-N-[[3-(2-phenoxyethoxy)phenyl]carbamothioyl]benzamide Traditional Name: 2-iodo-N-[[3-(2-phenoxyethoxy)phenyl]thiocarbamoyl]benzamide Formula: C22H19IN2O3S MolecularWeight: 518.36733

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C22H19IN2O3S/c23-20-12-5-4-11-19(20)21(26)25-22(29)24-16-7-6-10-18(15-16)28-14-13-27-17-8-2-1-3-9-17/h1-12,15H,13-14H2,(H2,24,25,26,29)