4-[1-ethyl-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[1-ethyl-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-ethyl-2-[[5-(2-furyl)isoxazol-3-yl]methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-ethyl-2-[[5-(2-furanyl)-3-isoxazolyl]methylthio]-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-ethyl-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-ethyl-2-[[5-(2-furyl)isoxazol-3-yl]methylthio]benzimidazol-5-yl]sulfonylmorpholine Formula: C21H22N4O5S2 MolecularWeight: 474.55318

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=NOC(=C4)C5=CC=CO5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=NOC(=C4)C5=CC=CO5

InChI

InChI=1S/C21H22N4O5S2/c1-2-25-18-6-5-16(32(26,27)24-7-10-28-11-8-24)13-17(18)22-21(25)31-14-15-12-20(30-23-15)19-4-3-9-29-19/h3-6,9,12-13H,2,7-8,10-11,14H2,1H3