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

Systemtic Name: N-[[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]carbamothioyl]butanamide Openeye Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamothioyl]butanamide CAS Name: N-[[[2-(2,4-dibromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]butanamide IUPAC Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamothioyl]butanamide Traditional Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]thiocarbamoyl]butyramide Formula: C13H15Br2N3O3S MolecularWeight: 453.1495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NNC(=O)COC1=C(C=C(C=C1)Br)Br

Isomeric SMILES

CCCC(=O)NC(=S)NNC(=O)COC1=C(C=C(C=C1)Br)Br

InChI

InChI=1S/C13H15Br2N3O3S/c1-2-3-11(19)16-13(22)18-17-12(20)7-21-10-5-4-8(14)6-9(10)15/h4-6H,2-3,7H2,1H3,(H,17,20)(H2,16,18,19,22)