ethyl 2-[1-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl]sulfanylpropanoate

Systemtic Name: ethyl 2-[1-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl]sulfanylpropanoate Openeye Name: ethyl 2-[1-(3-morpholinopropyl)-5-morpholinosulfonyl-benzimidazol-2-yl]sulfanylpropanoate CAS Name: 2-[[1-[3-(4-morpholinyl)propyl]-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[1-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylbenzimidazol-2-yl]sulfanylpropanoate Traditional Name: 2-[[1-(3-morpholinopropyl)-5-morpholinosulfonyl-benzimidazol-2-yl]thio]propionic acid ethyl ester Formula: C23H34N4O6S2 MolecularWeight: 526.66926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NC2=C(N1CCCN3CCOCC3)C=CC(=C2)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCOC(=O)C(C)SC1=NC2=C(N1CCCN3CCOCC3)C=CC(=C2)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H34N4O6S2/c1-3-33-22(28)18(2)34-23-24-20-17-19(35(29,30)26-11-15-32-16-12-26)5-6-21(20)27(23)8-4-7-25-9-13-31-14-10-25/h5-6,17-18H,3-4,7-16H2,1-2H3