N-tert-butyl-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-tert-butyl-2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-tert-butyl-2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-tert-butyl-2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]acetamide Formula: C19H28N4O4S2 MolecularWeight: 440.58002

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)NC(C)(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)NC(C)(C)C

InChI

InChI=1S/C19H28N4O4S2/c1-5-23-16-7-6-14(29(25,26)22-8-10-27-11-9-22)12-15(16)20-18(23)28-13-17(24)21-19(2,3)4/h6-7,12H,5,8-11,13H2,1-4H3,(H,21,24)