N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)phenyl]-2-[(1-phenethyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-(1-phenethylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[4-(4-ethylpiperazino)phenyl]-2-[(1-phenethylbenzimidazol-2-yl)thio]acetamide Formula: C29H33N5OS MolecularWeight: 499.67022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4N3CCC5=CC=CC=C5

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4N3CCC5=CC=CC=C5

InChI

InChI=1S/C29H33N5OS/c1-2-32-18-20-33(21-19-32)25-14-12-24(13-15-25)30-28(35)22-36-29-31-26-10-6-7-11-27(26)34(29)17-16-23-8-4-3-5-9-23/h3-15H,2,16-22H2,1H3,(H,30,35)