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

Systemtic Name: 6-[2-(4-chlorophenyl)-3-cyclopropyl-5-(2-fluorophenyl)imidazol-4-yl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine; methanesulfonate Openeye Name: 6-[2-(4-chlorophenyl)-3-cyclopropyl-5-(2-fluorophenyl)imidazol-4-yl]-1-isopropylsulfonyl-benzimidazol-2-amine; methanesulfonate CAS Name: 6-[2-(4-chlorophenyl)-3-cyclopropyl-5-(2-fluorophenyl)-4-imidazolyl]-1-propan-2-ylsulfonyl-2-benzimidazolamine; methanesulfonate IUPAC Name: 6-[2-(4-chlorophenyl)-3-cyclopropyl-5-(2-fluorophenyl)imidazol-4-yl]-1-propan-2-ylsulfonylbenzimidazol-2-amine; methanesulfonate Traditional Name: [6-[2-(4-chlorophenyl)-3-cyclopropyl-5-(2-fluorophenyl)imidazol-4-yl]-1-isopropylsulfonyl-benzimidazol-2-yl]amine mesylate Formula: C29H28ClFN5O5S2- MolecularWeight: 645.144523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(N=C(N3C4CC4)C5=CC=C(C=C5)Cl)C6=CC=CC=C6F)N=C1N.CS(=O)(=O)[O-]

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(N=C(N3C4CC4)C5=CC=C(C=C5)Cl)C6=CC=CC=C6F)N=C1N.CS(=O)(=O)[O-]

InChI

InChI=1S/C28H25ClFN5O2S.CH4O3S/c1-16(2)38(36,37)35-24-15-18(9-14-23(24)32-28(35)31)26-25(21-5-3-4-6-22(21)30)33-27(34(26)20-12-13-20)17-7-10-19(29)11-8-17;1-5(2,3)4/h3-11,14-16,20H,12-13H2,1-2H3,(H2,31,32);1H3,(H,2,3,4)/p-1