N-[(hexanoylamino)carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[(hexanoylamino)carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[(hexanoylamino)carbamothioyl]-2-phenyl-acetamide CAS Name: N-[(1-oxohexylhydrazo)-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[(hexanoylamino)carbamothioyl]-2-phenylacetamide Traditional Name: N-[(caproylamino)thiocarbamoyl]-2-phenyl-acetamide Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NNC(=S)NC(=O)CC1=CC=CC=C1

Isomeric SMILES

CCCCCC(=O)NNC(=S)NC(=O)CC1=CC=CC=C1

InChI

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