2-[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]sulfanyl-N,N-bis(2-cyanoethyl)ethanamide

Systemtic Name: 2-[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]sulfanyl-N,N-bis(2-cyanoethyl)ethanamide Openeye Name: 2-[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]sulfanyl-N,N-bis(2-cyanoethyl)acetamide CAS Name: 2-[[1-(3-chlorophenyl)-5-phenyl-2-imidazolyl]thio]-N,N-bis(2-cyanoethyl)acetamide IUPAC Name: 2-[1-(3-chlorophenyl)-5-phenylimidazol-2-yl]sulfanyl-N,N-bis(2-cyanoethyl)acetamide Traditional Name: 2-[[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]thio]-N,N-bis(2-cyanoethyl)acetamide Formula: C23H20ClN5OS MolecularWeight: 449.9558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C(N2C3=CC(=CC=C3)Cl)SCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C(N2C3=CC(=CC=C3)Cl)SCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C23H20ClN5OS/c24-19-9-4-10-20(15-19)29-21(18-7-2-1-3-8-18)16-27-23(29)31-17-22(30)28(13-5-11-25)14-6-12-26/h1-4,7-10,15-16H,5-6,13-14,17H2