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

Systemtic Name: N-[[[4-(pentanoylamino)phenyl]carbonylamino]carbamothioyl]hexanamide Openeye Name: N-[[[4-(pentanoylamino)benzoyl]amino]carbamothioyl]hexanamide CAS Name: N-[[[oxo-[4-(1-oxopentylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[[4-(pentanoylamino)benzoyl]amino]carbamothioyl]hexanamide Traditional Name: N-[[[4-(valerylamino)benzoyl]amino]thiocarbamoyl]hexanamide Formula: C19H28N4O3S MolecularWeight: 392.51562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O3S/c1-3-5-7-9-17(25)21-19(27)23-22-18(26)14-10-12-15(13-11-14)20-16(24)8-6-4-2/h10-13H,3-9H2,1-2H3,(H,20,24)(H,22,26)(H2,21,23,25,27)