6-[3-cyclopropyl-2-ethyl-5-(2-fluorophenyl)imidazol-4-yl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine; methanesulfonate

Systemtic Name: 6-[3-cyclopropyl-2-ethyl-5-(2-fluorophenyl)imidazol-4-yl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine; methanesulfonate Openeye Name: 6-[3-cyclopropyl-2-ethyl-5-(2-fluorophenyl)imidazol-4-yl]-1-isopropylsulfonyl-benzimidazol-2-amine; methanesulfonate CAS Name: 6-[3-cyclopropyl-2-ethyl-5-(2-fluorophenyl)-4-imidazolyl]-1-propan-2-ylsulfonyl-2-benzimidazolamine; methanesulfonate IUPAC Name: 6-[3-cyclopropyl-2-ethyl-5-(2-fluorophenyl)imidazol-4-yl]-1-propan-2-ylsulfonylbenzimidazol-2-amine; methanesulfonate Traditional Name: [6-[3-cyclopropyl-2-ethyl-5-(2-fluorophenyl)imidazol-4-yl]-1-isopropylsulfonyl-benzimidazol-2-yl]amine mesylate Formula: C25H29FN5O5S2- MolecularWeight: 562.656663

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1C2CC2)C3=CC4=C(C=C3)N=C(N4S(=O)(=O)C(C)C)N)C5=CC=CC=C5F.CS(=O)(=O)[O-]

Isomeric SMILES

CCC1=NC(=C(N1C2CC2)C3=CC4=C(C=C3)N=C(N4S(=O)(=O)C(C)C)N)C5=CC=CC=C5F.CS(=O)(=O)[O-]

InChI

InChI=1S/C24H26FN5O2S.CH4O3S/c1-4-21-28-22(17-7-5-6-8-18(17)25)23(29(21)16-10-11-16)15-9-12-19-20(13-15)30(24(26)27-19)33(31,32)14(2)3;1-5(2,3)4/h5-9,12-14,16H,4,10-11H2,1-3H3,(H2,26,27);1H3,(H,2,3,4)/p-1