N-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl]-1-(4-fluorophenyl)ethanamine

Systemtic Name: N-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl]-1-(4-fluorophenyl)ethanamine Openeye Name: N-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl]-1-(4-fluorophenyl)ethanamine CAS Name: N-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl]-1-(4-fluorophenyl)ethanamine IUPAC Name: N-[(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl]-1-(4-fluorophenyl)ethanamine Traditional Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl-[1-(4-fluorophenyl)ethyl]amine Formula: C22H27FN4O3S MolecularWeight: 446.538183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CNC(C)C4=CC=C(C=C4)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CNC(C)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H27FN4O3S/c1-3-27-21-9-8-19(31(28,29)26-10-12-30-13-11-26)14-20(21)25-22(27)15-24-16(2)17-4-6-18(23)7-5-17/h4-9,14,16,24H,3,10-13,15H2,1-2H3