N-[3-(3-methylphenoxy)propyl]-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-[3-(3-methylphenoxy)propyl]-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanamide Openeye Name: N-[3-(3-methylphenoxy)propyl]-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetamide CAS Name: N-[3-(3-methylphenoxy)propyl]-2-[2-(methylsulfonylmethyl)-1-benzimidazolyl]acetamide IUPAC Name: N-[3-(3-methylphenoxy)propyl]-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetamide Traditional Name: 2-[2-(mesylmethyl)benzimidazol-1-yl]-N-[3-(3-methylphenoxy)propyl]acetamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC(=O)CN2C3=CC=CC=C3N=C2CS(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC(=O)CN2C3=CC=CC=C3N=C2CS(=O)(=O)C

InChI

InChI=1S/C21H25N3O4S/c1-16-7-5-8-17(13-16)28-12-6-11-22-21(25)14-24-19-10-4-3-9-18(19)23-20(24)15-29(2,26)27/h3-5,7-10,13H,6,11-12,14-15H2,1-2H3,(H,22,25)