6-[2-ethyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine; methanesulfonic acid

Systemtic Name: 6-[2-ethyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine; methanesulfonic acid Openeye Name: 6-[2-ethyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-isopropylsulfonyl-benzimidazol-2-amine; methanesulfonic acid CAS Name: 6-[2-ethyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-2-benzimidazolamine; methanesulfonic acid IUPAC Name: 6-[2-ethyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-propan-2-ylsulfonylbenzimidazol-2-amine; methanesulfonic acid Traditional Name: [6-[2-ethyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-isopropylsulfonyl-benzimidazol-2-yl]amine; mesylic acid Formula: C22H26FN5O5S2 MolecularWeight: 523.600743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C2=CC=C(C=C2)F)C3=CC4=C(C=C3)N=C(N4S(=O)(=O)C(C)C)N.CS(=O)(=O)O

Isomeric SMILES

CCC1=NC(=C(N1)C2=CC=C(C=C2)F)C3=CC4=C(C=C3)N=C(N4S(=O)(=O)C(C)C)N.CS(=O)(=O)O

InChI

InChI=1S/C21H22FN5O2S.CH4O3S/c1-4-18-25-19(13-5-8-15(22)9-6-13)20(26-18)14-7-10-16-17(11-14)27(21(23)24-16)30(28,29)12(2)3;1-5(2,3)4/h5-12H,4H2,1-3H3,(H2,23,24)(H,25,26);1H3,(H,2,3,4)