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

Systemtic Name: methanesulfonic acid; 6-[2-(2-methylphenyl)-5-phenyl-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine Openeye Name: 1-isopropylsulfonyl-6-[2-(o-tolyl)-5-phenyl-1H-imidazol-4-yl]benzimidazol-2-amine; methanesulfonic acid CAS Name: methanesulfonic acid; 6-[2-(2-methylphenyl)-5-phenyl-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-2-benzimidazolamine IUPAC Name: methanesulfonic acid; 6-[2-(2-methylphenyl)-5-phenyl-1H-imidazol-4-yl]-1-propan-2-ylsulfonylbenzimidazol-2-amine Traditional Name: [1-isopropylsulfonyl-6-[2-(o-tolyl)-5-phenyl-1H-imidazol-4-yl]benzimidazol-2-yl]amine; mesylic acid Formula: C27H29N5O5S2 MolecularWeight: 567.67966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=C(N2)C3=CC=CC=C3)C4=CC5=C(C=C4)N=C(N5S(=O)(=O)C(C)C)N.CS(=O)(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=C(N2)C3=CC=CC=C3)C4=CC5=C(C=C4)N=C(N5S(=O)(=O)C(C)C)N.CS(=O)(=O)O

InChI

InChI=1S/C26H25N5O2S.CH4O3S/c1-16(2)34(32,33)31-22-15-19(13-14-21(22)28-26(31)27)24-23(18-10-5-4-6-11-18)29-25(30-24)20-12-8-7-9-17(20)3;1-5(2,3)4/h4-16H,1-3H3,(H2,27,28)(H,29,30);1H3,(H,2,3,4)