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

Systemtic Name: 4-[2-[2-(3-bromanylphenoxy)ethylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[2-(3-bromophenoxy)ethylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[2-(3-bromophenoxy)ethylthio]-1-ethyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[2-(3-bromophenoxy)ethylsulfanyl]-1-ethylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[2-(3-bromophenoxy)ethylthio]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C21H24BrN3O4S2 MolecularWeight: 526.46696

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCOC4=CC(=CC=C4)Br

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCOC4=CC(=CC=C4)Br

InChI

InChI=1S/C21H24BrN3O4S2/c1-2-25-20-7-6-18(31(26,27)24-8-10-28-11-9-24)15-19(20)23-21(25)30-13-12-29-17-5-3-4-16(22)14-17/h3-7,14-15H,2,8-13H2,1H3