3-bromanyl-4-butoxy-N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[[(2-iodobenzoyl)amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[[[(2-iodophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[[(2-iodobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[[(2-iodobenzoyl)amino]thiocarbamoyl]benzamide Formula: C19H19BrIN3O3S MolecularWeight: 576.24593

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2I)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2I)Br

InChI

InChI=1S/C19H19BrIN3O3S/c1-2-3-10-27-16-9-8-12(11-14(16)20)17(25)22-19(28)24-23-18(26)13-6-4-5-7-15(13)21/h4-9,11H,2-3,10H2,1H3,(H,23,26)(H2,22,24,25,28)