N-(4-morpholin-4-ylphenyl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-(4-morpholin-4-ylphenyl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanamide Openeye Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-N-(4-morpholinophenyl)acetamide CAS Name: N-[4-(4-morpholinyl)phenyl]-2-[2-(phenylmethylthio)-1-benzimidazolyl]acetamide IUPAC Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[2-(benzylthio)benzimidazol-1-yl]-N-(4-morpholinophenyl)acetamide Formula: C26H26N4O2S MolecularWeight: 458.57524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5

InChI

InChI=1S/C26H26N4O2S/c31-25(27-21-10-12-22(13-11-21)29-14-16-32-17-15-29)18-30-24-9-5-4-8-23(24)28-26(30)33-19-20-6-2-1-3-7-20/h1-13H,14-19H2,(H,27,31)