N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]-2-propan-2-yloxy-benzamide

Systemtic Name: N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]-2-propan-2-yloxy-benzamide Openeye Name: 2-isopropoxy-N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]benzamide CAS Name: N-[[3-[(1-oxo-3-phenylpropyl)amino]anilino]-sulfanylidenemethyl]-2-propan-2-yloxybenzamide IUPAC Name: N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]-2-propan-2-yloxybenzamide Traditional Name: N-[[3-(hydrocinnamoylamino)phenyl]thiocarbamoyl]-2-isopropoxy-benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-18(2)32-23-14-7-6-13-22(23)25(31)29-26(33)28-21-12-8-11-20(17-21)27-24(30)16-15-19-9-4-3-5-10-19/h3-14,17-18H,15-16H2,1-2H3,(H,27,30)(H2,28,29,31,33)