ethyl 2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanylethanoate Openeye Name: ethyl 2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanylacetate CAS Name: 2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]acetic acid ethyl ester Formula: C17H23N3O5S2 MolecularWeight: 413.51162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)OCC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)OCC

InChI

InChI=1S/C17H23N3O5S2/c1-3-20-15-6-5-13(27(22,23)19-7-9-24-10-8-19)11-14(15)18-17(20)26-12-16(21)25-4-2/h5-6,11H,3-4,7-10,12H2,1-2H3