3-(2-phenoxyethoxy)-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-(2-phenoxyethoxy)-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 3-(2-phenoxyethoxy)-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide CAS Name: N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-3-(2-phenoxyethoxy)benzamide IUPAC Name: 3-(2-phenoxyethoxy)-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 3-(2-phenoxyethoxy)-N-[(3-propionamidophenyl)thiocarbamoyl]benzamide Formula: C25H25N3O4S MolecularWeight: 463.5487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O4S/c1-2-23(29)26-19-9-7-10-20(17-19)27-25(33)28-24(30)18-8-6-13-22(16-18)32-15-14-31-21-11-4-3-5-12-21/h3-13,16-17H,2,14-15H2,1H3,(H,26,29)(H2,27,28,30,33)