N-[[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[[2-(2,4-dibromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[[2-(2,4-dibromophenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H23Br2N3O4S MolecularWeight: 573.29802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Br)Br

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Br)Br

InChI

InChI=1S/C21H23Br2N3O4S/c1-2-3-6-11-29-17-8-5-4-7-15(17)20(28)24-21(31)26-25-19(27)13-30-18-10-9-14(22)12-16(18)23/h4-5,7-10,12H,2-3,6,11,13H2,1H3,(H,25,27)(H2,24,26,28,31)