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

Systemtic Name: N-[[[4-(propanoylamino)phenyl]carbonylamino]carbamothioyl]pentanamide Openeye Name: N-[[[4-(propanoylamino)benzoyl]amino]carbamothioyl]pentanamide CAS Name: N-[[[oxo-[4-(1-oxopropylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[[4-(propanoylamino)benzoyl]amino]carbamothioyl]pentanamide Traditional Name: N-[[(4-propionamidobenzoyl)amino]thiocarbamoyl]valeramide Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O3S/c1-3-5-6-14(22)18-16(24)20-19-15(23)11-7-9-12(10-8-11)17-13(21)4-2/h7-10H,3-6H2,1-2H3,(H,17,21)(H,19,23)(H2,18,20,22,24)