4-hexoxy-N-[(2-phenoxyethanoylamino)carbamothioyl]benzamide

Systemtic Name: 4-hexoxy-N-[(2-phenoxyethanoylamino)carbamothioyl]benzamide Openeye Name: 4-hexoxy-N-[[(2-phenoxyacetyl)amino]carbamothioyl]benzamide CAS Name: 4-hexoxy-N-[[(1-oxo-2-phenoxyethyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-hexoxy-N-[[(2-phenoxyacetyl)amino]carbamothioyl]benzamide Traditional Name: 4-hexoxy-N-[[(2-phenoxyacetyl)amino]thiocarbamoyl]benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C22H27N3O4S/c1-2-3-4-8-15-28-19-13-11-17(12-14-19)21(27)23-22(30)25-24-20(26)16-29-18-9-6-5-7-10-18/h5-7,9-14H,2-4,8,15-16H2,1H3,(H,24,26)(H2,23,25,27,30)