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

Systemtic Name: 4-[1-ethyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-ethyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-ethyl-2-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-ethyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-ethyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylthio]benzimidazol-5-yl]sulfonylmorpholine Formula: C21H22N4O4S3 MolecularWeight: 490.61878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=NOC(=C4)C5=CC=CS5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=NOC(=C4)C5=CC=CS5

InChI

InChI=1S/C21H22N4O4S3/c1-2-25-18-6-5-16(32(26,27)24-7-9-28-10-8-24)13-17(18)22-21(25)31-14-15-12-19(29-23-15)20-4-3-11-30-20/h3-6,11-13H,2,7-10,14H2,1H3