N-[[[4-(propanoylamino)phenyl]carbonylamino]carbamothioyl]hexanamide

Systemtic Name: N-[[[4-(propanoylamino)phenyl]carbonylamino]carbamothioyl]hexanamide Openeye Name: N-[[[4-(propanoylamino)benzoyl]amino]carbamothioyl]hexanamide CAS Name: N-[[[oxo-[4-(1-oxopropylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[[4-(propanoylamino)benzoyl]amino]carbamothioyl]hexanamide Traditional Name: N-[[(4-propionamidobenzoyl)amino]thiocarbamoyl]hexanamide Formula: C17H24N4O3S MolecularWeight: 364.46246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)CC

Isomeric SMILES

CCCCCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)CC

InChI

InChI=1S/C17H24N4O3S/c1-3-5-6-7-15(23)19-17(25)21-20-16(24)12-8-10-13(11-9-12)18-14(22)4-2/h8-11H,3-7H2,1-2H3,(H,18,22)(H,20,24)(H2,19,21,23,25)