N-[(2-phenoxyethanoylamino)carbamothioyl]pentanamide

Systemtic Name: N-[(2-phenoxyethanoylamino)carbamothioyl]pentanamide Openeye Name: N-[[(2-phenoxyacetyl)amino]carbamothioyl]pentanamide CAS Name: N-[[(1-oxo-2-phenoxyethyl)hydrazo]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[(2-phenoxyacetyl)amino]carbamothioyl]pentanamide Traditional Name: N-[[(2-phenoxyacetyl)amino]thiocarbamoyl]valeramide Formula: C14H19N3O3S MolecularWeight: 309.38396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NNC(=O)COC1=CC=CC=C1

Isomeric SMILES

CCCCC(=O)NC(=S)NNC(=O)COC1=CC=CC=C1

InChI

InChI=1S/C14H19N3O3S/c1-2-3-9-12(18)15-14(21)17-16-13(19)10-20-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,16,19)(H2,15,17,18,21)