N-[[2-(2-chloranylphenoxy)ethanoylamino]carbamothioyl]butanamide

Systemtic Name: N-[[2-(2-chloranylphenoxy)ethanoylamino]carbamothioyl]butanamide Openeye Name: N-[[[2-(2-chlorophenoxy)acetyl]amino]carbamothioyl]butanamide CAS Name: N-[[[2-(2-chlorophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]butanamide IUPAC Name: N-[[[2-(2-chlorophenoxy)acetyl]amino]carbamothioyl]butanamide Traditional Name: N-[[[2-(2-chlorophenoxy)acetyl]amino]thiocarbamoyl]butyramide Formula: C13H16ClN3O3S MolecularWeight: 329.80244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NNC(=O)COC1=CC=CC=C1Cl

Isomeric SMILES

CCCC(=O)NC(=S)NNC(=O)COC1=CC=CC=C1Cl

InChI

InChI=1S/C13H16ClN3O3S/c1-2-5-11(18)15-13(21)17-16-12(19)8-20-10-7-4-3-6-9(10)14/h3-4,6-7H,2,5,8H2,1H3,(H,16,19)(H2,15,17,18,21)