ethyl-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl]-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium

Systemtic Name: ethyl-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl]-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium Openeye Name: ethyl-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl]-[(3-fluoro-4-methoxy-phenyl)methyl]ammonium CAS Name: ethyl-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl]-[(3-fluoro-4-methoxyphenyl)methyl]ammonium IUPAC Name: ethyl-[(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl]-[(3-fluoro-4-methoxyphenyl)methyl]azanium Traditional Name: ethyl-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl]-(3-fluoro-4-methoxy-benzyl)ammonium Formula: C24H32FN4O4S+ MolecularWeight: 491.598683

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C[NH+](CC)CC4=CC(=C(C=C4)OC)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C[NH+](CC)CC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C24H31FN4O4S/c1-4-27(16-18-6-9-23(32-3)20(25)14-18)17-24-26-21-15-19(7-8-22(21)29(24)5-2)34(30,31)28-10-12-33-13-11-28/h6-9,14-15H,4-5,10-13,16-17H2,1-3H3/p+1