N-[[3-(propanoylamino)phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[3-(propanoylamino)phenyl]carbamothioyl]hexanamide Openeye Name: N-[[3-(propanoylamino)phenyl]carbamothioyl]hexanamide CAS Name: N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[3-(propanoylamino)phenyl]carbamothioyl]hexanamide Traditional Name: N-[(3-propionamidophenyl)thiocarbamoyl]hexanamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)CC

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)CC

InChI

InChI=1S/C16H23N3O2S/c1-3-5-6-10-15(21)19-16(22)18-13-9-7-8-12(11-13)17-14(20)4-2/h7-9,11H,3-6,10H2,1-2H3,(H,17,20)(H2,18,19,21,22)