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

Systemtic Name: methanesulfonic acid; 6-(2-methyl-5-phenyl-1H-imidazol-4-yl)-1-propan-2-ylsulfonyl-benzimidazol-2-amine Openeye Name: 1-isopropylsulfonyl-6-(2-methyl-5-phenyl-1H-imidazol-4-yl)benzimidazol-2-amine; methanesulfonic acid CAS Name: methanesulfonic acid; 6-(2-methyl-5-phenyl-1H-imidazol-4-yl)-1-propan-2-ylsulfonyl-2-benzimidazolamine IUPAC Name: methanesulfonic acid; 6-(2-methyl-5-phenyl-1H-imidazol-4-yl)-1-propan-2-ylsulfonylbenzimidazol-2-amine Traditional Name: [1-isopropylsulfonyl-6-(2-methyl-5-phenyl-1H-imidazol-4-yl)benzimidazol-2-yl]amine; mesylic acid Formula: C22H29N5O8S3 MolecularWeight: 587.68936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1)C2=CC=CC=C2)C3=CC4=C(C=C3)N=C(N4S(=O)(=O)C(C)C)N.CS(=O)(=O)O.CS(=O)(=O)O

Isomeric SMILES

CC1=NC(=C(N1)C2=CC=CC=C2)C3=CC4=C(C=C3)N=C(N4S(=O)(=O)C(C)C)N.CS(=O)(=O)O.CS(=O)(=O)O

InChI

InChI=1S/C20H21N5O2S.2CH4O3S/c1-12(2)28(26,27)25-17-11-15(9-10-16(17)24-20(25)21)19-18(22-13(3)23-19)14-7-5-4-6-8-14;2*1-5(2,3)4/h4-12H,1-3H3,(H2,21,24)(H,22,23);2*1H3,(H,2,3,4)