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

Systemtic Name: 6-[2-(5-ethylthiophen-2-yl)-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine; methanesulfonic acid Openeye Name: 6-[2-(5-ethyl-2-thienyl)-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-isopropylsulfonyl-benzimidazol-2-amine; methanesulfonic acid CAS Name: 6-[2-(5-ethyl-2-thiophenyl)-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-2-benzimidazolamine; methanesulfonic acid IUPAC Name: 6-[2-(5-ethylthiophen-2-yl)-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-propan-2-ylsulfonylbenzimidazol-2-amine; methanesulfonic acid Traditional Name: [6-[2-(5-ethyl-2-thienyl)-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-isopropylsulfonyl-benzimidazol-2-yl]amine; mesylic acid Formula: C26H28FN5O5S3 MolecularWeight: 605.724423

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC(=C(N2)C3=CC=C(C=C3)F)C4=CC5=C(C=C4)N=C(N5S(=O)(=O)C(C)C)N.CS(=O)(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C2=NC(=C(N2)C3=CC=C(C=C3)F)C4=CC5=C(C=C4)N=C(N5S(=O)(=O)C(C)C)N.CS(=O)(=O)O

InChI

InChI=1S/C25H24FN5O2S2.CH4O3S/c1-4-18-10-12-21(34-18)24-29-22(15-5-8-17(26)9-6-15)23(30-24)16-7-11-19-20(13-16)31(25(27)28-19)35(32,33)14(2)3;1-5(2,3)4/h5-14H,4H2,1-3H3,(H2,27,28)(H,29,30);1H3,(H,2,3,4)