methanesulfonic acid; 6-(2-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-1-propan-2-ylsulfonyl-benzimidazol-2-amine

Systemtic Name: methanesulfonic acid; 6-(2-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-1-propan-2-ylsulfonyl-benzimidazol-2-amine Openeye Name: 1-isopropylsulfonyl-6-(2-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)benzimidazol-2-amine; methanesulfonic acid CAS Name: methanesulfonic acid; 6-(2-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-1-propan-2-ylsulfonyl-2-benzimidazolamine IUPAC Name: methanesulfonic acid; 6-(2-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-1-propan-2-ylsulfonylbenzimidazol-2-amine Traditional Name: [1-isopropylsulfonyl-6-(2-phenyl-6,7-dihydro-5H-pyrrol[1,2-a]imidazol-3-yl)benzimidazol-2-yl]amine; mesylic acid Formula: C24H31N5O8S3 MolecularWeight: 613.72664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(N=C4N3CCC4)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(N=C4N3CCC4)C5=CC=CC=C5)N=C1N.CS(=O)(=O)O.CS(=O)(=O)O

InChI

InChI=1S/C22H23N5O2S.2CH4O3S/c1-14(2)30(28,29)27-18-13-16(10-11-17(18)24-22(27)23)21-20(15-7-4-3-5-8-15)25-19-9-6-12-26(19)21;2*1-5(2,3)4/h3-5,7-8,10-11,13-14H,6,9,12H2,1-2H3,(H2,23,24);2*1H3,(H,2,3,4)