N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-2,3,4-tris(fluoranyl)aniline

Systemtic Name: N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-2,3,4-tris(fluoranyl)aniline Openeye Name: N-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]-2,3,4-trifluoro-aniline CAS Name: N-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-2,3,4-trifluoroaniline IUPAC Name: N-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]-2,3,4-trifluoroaniline Traditional Name: (1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl-(2,3,4-trifluorophenyl)amine Formula: C21H23F3N4O2S MolecularWeight: 452.49313

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23F3N4O2S/c1-2-28-18-9-6-14(31(29,30)27-10-4-3-5-11-27)12-17(18)26-19(28)13-25-16-8-7-15(22)20(23)21(16)24/h6-9,12,25H,2-5,10-11,13H2,1H3