4-[1-ethyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[1-ethyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-ethyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-ethyl-2-[(3-methyl-2-quinoxalinyl)methylthio]-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-ethyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-ethyl-2-[(3-methylquinoxalin-2-yl)methylthio]benzimidazol-5-yl]sulfonylmorpholine Formula: C23H25N5O3S2 MolecularWeight: 483.6063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=NC5=CC=CC=C5N=C4C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=NC5=CC=CC=C5N=C4C

InChI

InChI=1S/C23H25N5O3S2/c1-3-28-22-9-8-17(33(29,30)27-10-12-31-13-11-27)14-20(22)26-23(28)32-15-21-16(2)24-18-6-4-5-7-19(18)25-21/h4-9,14H,3,10-13,15H2,1-2H3