N-[(4-bromanyl-2-iodanyl-phenyl)carbamothioyl]hexanamide

Systemtic Name: N-[(4-bromanyl-2-iodanyl-phenyl)carbamothioyl]hexanamide Openeye Name: N-[(4-bromo-2-iodo-phenyl)carbamothioyl]hexanamide CAS Name: N-[(4-bromo-2-iodoanilino)-sulfanylidenemethyl]hexanamide IUPAC Name: N-[(4-bromo-2-iodophenyl)carbamothioyl]hexanamide Traditional Name: N-[(4-bromo-2-iodo-phenyl)thiocarbamoyl]hexanamide Formula: C13H16BrIN2OS MolecularWeight: 455.15241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=C(C=C(C=C1)Br)I

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=C(C=C(C=C1)Br)I

InChI

InChI=1S/C13H16BrIN2OS/c1-2-3-4-5-12(18)17-13(19)16-11-7-6-9(14)8-10(11)15/h6-8H,2-5H2,1H3,(H2,16,17,18,19)