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

Systemtic Name: (1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl pentanoate Openeye Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl pentanoate CAS Name: pentanoic acid [1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl pentanoate Traditional Name: valeric acid (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C19H27N3O5S MolecularWeight: 409.49978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCCCC(=O)OCC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H27N3O5S/c1-3-5-6-19(23)27-14-18-20-16-13-15(7-8-17(16)22(18)4-2)28(24,25)21-9-11-26-12-10-21/h7-8,13H,3-6,9-12,14H2,1-2H3