3-[2,2-diphenylethanoylcarbamothioyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[2,2-diphenylethanoylcarbamothioyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[(2,2-diphenylacetyl)carbamothioyl]amino]propanamide CAS Name: 3-[[[(1-oxo-2,2-diphenylethyl)amino]-sulfanylidenemethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[(2,2-diphenylacetyl)carbamothioyl]amino]propanamide Traditional Name: 3-[benzyl-[(2,2-diphenylacetyl)thiocarbamoyl]amino]propionamide Formula: C25H25N3O2S MolecularWeight: 431.5499

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC(=O)N)C(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC(=O)N)C(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H25N3O2S/c26-22(29)16-17-28(18-19-10-4-1-5-11-19)25(31)27-24(30)23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,23H,16-18H2,(H2,26,29)(H,27,30,31)