2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[2-(phenylmethylthio)-1-benzimidazolyl]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-[2-(benzylthio)benzimidazol-1-yl]-N-mesityl-acetamide Formula: C25H25N3OS MolecularWeight: 415.5505

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CN2C3=CC=CC=C3N=C2SCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CN2C3=CC=CC=C3N=C2SCC4=CC=CC=C4)C

InChI

InChI=1S/C25H25N3OS/c1-17-13-18(2)24(19(3)14-17)27-23(29)15-28-22-12-8-7-11-21(22)26-25(28)30-16-20-9-5-4-6-10-20/h4-14H,15-16H2,1-3H3,(H,27,29)