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

Systemtic Name: 4-[1-ethyl-2-(3-phenoxypropylsulfanyl)benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-ethyl-2-(3-phenoxypropylsulfanyl)benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-ethyl-2-(3-phenoxypropylthio)-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-ethyl-2-(3-phenoxypropylsulfanyl)benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-ethyl-2-(3-phenoxypropylthio)benzimidazol-5-yl]sulfonylmorpholine Formula: C22H27N3O4S2 MolecularWeight: 461.59748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCCOC4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCCOC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O4S2/c1-2-25-21-10-9-19(31(26,27)24-11-14-28-15-12-24)17-20(21)23-22(25)30-16-6-13-29-18-7-4-3-5-8-18/h3-5,7-10,17H,2,6,11-16H2,1H3