4-butoxy-N-(1H-imidazol-5-ylmethyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide

Systemtic Name: 4-butoxy-N-(1H-imidazol-5-ylmethyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide Openeye Name: 4-butoxy-N-(1H-imidazol-5-ylmethyl)-N-[2-(2-thienyl)ethyl]benzenesulfonamide CAS Name: 4-butoxy-N-(1H-imidazol-5-ylmethyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide IUPAC Name: 4-butoxy-N-(1H-imidazol-5-ylmethyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide Traditional Name: 4-butoxy-N-(1H-imidazol-5-ylmethyl)-N-[2-(2-thienyl)ethyl]benzenesulfonamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CS2)CC3=CN=CN3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CS2)CC3=CN=CN3

InChI

InChI=1S/C20H25N3O3S2/c1-2-3-12-26-18-6-8-20(9-7-18)28(24,25)23(15-17-14-21-16-22-17)11-10-19-5-4-13-27-19/h4-9,13-14,16H,2-3,10-12,15H2,1H3,(H,21,22)