[(3S)-2-oxidanylideneoxolan-3-yl] 3-(1-butyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanoate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 3-(1-butyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanoate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 3-(1-butyl-5-morpholinosulfonyl-benzimidazol-2-yl)propanoate CAS Name: 3-[1-butyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]propanoic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 3-(1-butyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanoate Traditional Name: 3-(1-butyl-5-morpholinosulfonyl-benzimidazol-2-yl)propionic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C22H29N3O7S MolecularWeight: 479.54656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)OC4CCOC4=O

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)O[C@H]4CCOC4=O

InChI

InChI=1S/C22H29N3O7S/c1-2-3-9-25-18-5-4-16(33(28,29)24-10-13-30-14-11-24)15-17(18)23-20(25)6-7-21(26)32-19-8-12-31-22(19)27/h4-5,15,19H,2-3,6-14H2,1H3/t19-/m0/s1