N-(1-phenylethyl)-2-(3-phenylpropanoylcarbamothioylamino)benzamide

Systemtic Name: N-(1-phenylethyl)-2-(3-phenylpropanoylcarbamothioylamino)benzamide Openeye Name: N-(1-phenylethyl)-2-(3-phenylpropanoylcarbamothioylamino)benzamide CAS Name: 2-[[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: N-(1-phenylethyl)-2-(3-phenylpropanoylcarbamothioylamino)benzamide Traditional Name: 2-(hydrocinnamoylthiocarbamoylamino)-N-(1-phenylethyl)benzamide Formula: C25H25N3O2S MolecularWeight: 431.5499

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O2S/c1-18(20-12-6-3-7-13-20)26-24(30)21-14-8-9-15-22(21)27-25(31)28-23(29)17-16-19-10-4-2-5-11-19/h2-15,18H,16-17H2,1H3,(H,26,30)(H2,27,28,29,31)