4-[2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanylethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanylethoxy]benzenecarbonitrile Openeye Name: 4-[2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanylethoxy]benzonitrile CAS Name: 4-[2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]ethoxy]benzonitrile IUPAC Name: 4-[2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylethoxy]benzonitrile Traditional Name: 4-[2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]ethoxy]benzonitrile Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCOC4=CC=C(C=C4)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCOC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H24N4O4S2/c1-2-26-21-8-7-19(32(27,28)25-9-11-29-12-10-25)15-20(21)24-22(26)31-14-13-30-18-5-3-17(16-23)4-6-18/h3-8,15H,2,9-14H2,1H3