N-(cyclododecylcarbamothioyl)-3-phenyl-propanamide

Systemtic Name: N-(cyclododecylcarbamothioyl)-3-phenyl-propanamide Openeye Name: N-(cyclododecylcarbamothioyl)-3-phenyl-propanamide CAS Name: N-[(cyclododecylamino)-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-(cyclododecylcarbamothioyl)-3-phenylpropanamide Traditional Name: N-(cyclododecylthiocarbamoyl)-3-phenyl-propionamide Formula: C22H34N2OS MolecularWeight: 374.58316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)NC(=S)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

C1CCCCCC(CCCCC1)NC(=S)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C22H34N2OS/c25-21(18-17-19-13-9-8-10-14-19)24-22(26)23-20-15-11-6-4-2-1-3-5-7-12-16-20/h8-10,13-14,20H,1-7,11-12,15-18H2,(H2,23,24,25,26)