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

Systemtic Name: (1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl butanoate Openeye Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl butanoate CAS Name: butanoic acid [1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl butanoate Traditional Name: butyric acid (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O5S/c1-3-5-18(22)26-13-17-19-15-12-14(6-7-16(15)21(17)4-2)27(23,24)20-8-10-25-11-9-20/h6-7,12H,3-5,8-11,13H2,1-2H3