methanesulfonic acid; 6-(5-phenyl-2-pyridin-3-yl-1H-imidazol-4-yl)-1-propan-2-ylsulfonyl-benzimidazol-2-amine

Systemtic Name: methanesulfonic acid; 6-(5-phenyl-2-pyridin-3-yl-1H-imidazol-4-yl)-1-propan-2-ylsulfonyl-benzimidazol-2-amine Openeye Name: 1-isopropylsulfonyl-6-[5-phenyl-2-(3-pyridyl)-1H-imidazol-4-yl]benzimidazol-2-amine; methanesulfonic acid CAS Name: methanesulfonic acid; 6-[5-phenyl-2-(3-pyridinyl)-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-2-benzimidazolamine IUPAC Name: methanesulfonic acid; 6-(5-phenyl-2-pyridin-3-yl-1H-imidazol-4-yl)-1-propan-2-ylsulfonylbenzimidazol-2-amine Traditional Name: [1-isopropylsulfonyl-6-[5-phenyl-2-(3-pyridyl)-1H-imidazol-4-yl]benzimidazol-2-yl]amine; mesylic acid Formula: C26H30N6O8S3 MolecularWeight: 650.7468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(NC(=N3)C4=CN=CC=C4)C5=CC=CC=C5)N=C1N.CS(=O)(=O)O.CS(=O)(=O)O

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(NC(=N3)C4=CN=CC=C4)C5=CC=CC=C5)N=C1N.CS(=O)(=O)O.CS(=O)(=O)O

InChI

InChI=1S/C24H22N6O2S.2CH4O3S/c1-15(2)33(31,32)30-20-13-17(10-11-19(20)27-24(30)25)22-21(16-7-4-3-5-8-16)28-23(29-22)18-9-6-12-26-14-18;2*1-5(2,3)4/h3-15H,1-2H3,(H2,25,27)(H,28,29);2*1H3,(H,2,3,4)