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

Systemtic Name: butyl 2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanylethanoate Openeye Name: butyl 2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanylacetate CAS Name: 2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]acetic acid butyl ester Formula: C19H27N3O5S2 MolecularWeight: 441.56478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCCCOC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H27N3O5S2/c1-3-5-10-27-18(23)14-28-19-20-16-13-15(6-7-17(16)22(19)4-2)29(24,25)21-8-11-26-12-9-21/h6-7,13H,3-5,8-12,14H2,1-2H3