4-[2-[(3-chlorophenyl)methylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-[(3-chlorophenyl)methylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[(3-chlorophenyl)methylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[(3-chlorophenyl)methylthio]-1-ethyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[(3-chlorophenyl)methylsulfanyl]-1-ethylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[(3-chlorobenzyl)thio]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=CC(=CC=C4)Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H22ClN3O3S2/c1-2-24-19-7-6-17(29(25,26)23-8-10-27-11-9-23)13-18(19)22-20(24)28-14-15-4-3-5-16(21)12-15/h3-7,12-13H,2,8-11,14H2,1H3