N,N-diethyl-2-[(2-methylphenyl)methylsulfanyl]-1-propan-2-yl-benzimidazole-5-sulfonamide

Systemtic Name: N,N-diethyl-2-[(2-methylphenyl)methylsulfanyl]-1-propan-2-yl-benzimidazole-5-sulfonamide Openeye Name: N,N-diethyl-1-isopropyl-2-(o-tolylmethylsulfanyl)benzimidazole-5-sulfonamide CAS Name: N,N-diethyl-2-[(2-methylphenyl)methylthio]-1-propan-2-yl-5-benzimidazolesulfonamide IUPAC Name: N,N-diethyl-2-[(2-methylphenyl)methylsulfanyl]-1-propan-2-ylbenzimidazole-5-sulfonamide Traditional Name: N,N-diethyl-1-isopropyl-2-[(2-methylbenzyl)thio]benzimidazole-5-sulfonamide Formula: C22H29N3O2S2 MolecularWeight: 431.61456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC=C3C)C(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC=C3C)C(C)C

InChI

InChI=1S/C22H29N3O2S2/c1-6-24(7-2)29(26,27)19-12-13-21-20(14-19)23-22(25(21)16(3)4)28-15-18-11-9-8-10-17(18)5/h8-14,16H,6-7,15H2,1-5H3