3-bromanyl-N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[[[2-(4-bromophenoxy)acetyl]amino]thiocarbamoyl]-4-propoxy-benzamide Formula: C19H19Br2N3O4S MolecularWeight: 545.24486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)Br)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)Br)Br

InChI

InChI=1S/C19H19Br2N3O4S/c1-2-9-27-16-8-3-12(10-15(16)21)18(26)22-19(29)24-23-17(25)11-28-14-6-4-13(20)5-7-14/h3-8,10H,2,9,11H2,1H3,(H,23,25)(H2,22,24,26,29)