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

Systemtic Name: 4-[1-ethyl-2-(3-phenylpropylsulfanyl)benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-ethyl-2-(3-phenylpropylsulfanyl)benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-ethyl-2-(3-phenylpropylthio)-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-ethyl-2-(3-phenylpropylsulfanyl)benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-ethyl-2-(3-phenylpropylthio)benzimidazol-5-yl]sulfonylmorpholine Formula: C22H27N3O3S2 MolecularWeight: 445.59808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCCC4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCCC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O3S2/c1-2-25-21-11-10-19(30(26,27)24-12-14-28-15-13-24)17-20(21)23-22(25)29-16-6-9-18-7-4-3-5-8-18/h3-5,7-8,10-11,17H,2,6,9,12-16H2,1H3