N-[(3-phenylpropanoylamino)carbamothioyl]pentanamide

Systemtic Name: N-[(3-phenylpropanoylamino)carbamothioyl]pentanamide Openeye Name: N-[(3-phenylpropanoylamino)carbamothioyl]pentanamide CAS Name: N-[[(1-oxo-3-phenylpropyl)hydrazo]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[(3-phenylpropanoylamino)carbamothioyl]pentanamide Traditional Name: N-[(hydrocinnamoylamino)thiocarbamoyl]valeramide Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NNC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CCCCC(=O)NC(=S)NNC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C15H21N3O2S/c1-2-3-9-13(19)16-15(21)18-17-14(20)11-10-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3,(H,17,20)(H2,16,18,19,21)