4-heptoxy-N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-heptoxy-N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-heptoxy-N-[[(2-iodobenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-heptoxy-N-[[[(2-iodophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-[[(2-iodobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-heptoxy-N-[[(2-iodobenzoyl)amino]thiocarbamoyl]benzamide Formula: C22H26IN3O3S MolecularWeight: 539.42961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2I

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C22H26IN3O3S/c1-2-3-4-5-8-15-29-17-13-11-16(12-14-17)20(27)24-22(30)26-25-21(28)18-9-6-7-10-19(18)23/h6-7,9-14H,2-5,8,15H2,1H3,(H,25,28)(H2,24,26,27,30)