N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-2-fluoranyl-4-methyl-aniline

Systemtic Name: N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-2-fluoranyl-4-methyl-aniline Openeye Name: N-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]-2-fluoro-4-methyl-aniline CAS Name: N-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-2-fluoro-4-methylaniline IUPAC Name: N-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]-2-fluoro-4-methylaniline Traditional Name: (1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl-(2-fluoro-4-methyl-phenyl)amine Formula: C22H27FN4O2S MolecularWeight: 430.538783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CNC4=C(C=C(C=C4)C)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CNC4=C(C=C(C=C4)C)F

InChI

InChI=1S/C22H27FN4O2S/c1-3-27-21-10-8-17(30(28,29)26-11-5-4-6-12-26)14-20(21)25-22(27)15-24-19-9-7-16(2)13-18(19)23/h7-10,13-14,24H,3-6,11-12,15H2,1-2H3