3-[6-[2-(6-methylpyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]benzimidazol-1-yl]propyl methanesulfonate

Systemtic Name: 3-[6-[2-(6-methylpyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]benzimidazol-1-yl]propyl methanesulfonate Openeye Name: 3-[6-[2-(6-methyl-2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]benzimidazol-1-yl]propyl methanesulfonate CAS Name: methanesulfonic acid 3-[6-[2-(6-methyl-2-pyridinyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-1-benzimidazolyl]propyl ester IUPAC Name: 3-[6-[2-(6-methylpyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]benzimidazol-1-yl]propyl methanesulfonate Traditional Name: methanesulfonic acid 3-[6-[2-(6-methyl-2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]benzimidazol-1-yl]propyl ester Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C2=NN3CCCC3=C2C4=CC5=C(C=C4)N=CN5CCCOS(=O)(=O)C

Isomeric SMILES

CC1=CC=CC(=N1)C2=NN3CCCC3=C2C4=CC5=C(C=C4)N=CN5CCCOS(=O)(=O)C

InChI

InChI=1S/C23H25N5O3S/c1-16-6-3-7-19(25-16)23-22(20-8-4-12-28(20)26-23)17-9-10-18-21(14-17)27(15-24-18)11-5-13-31-32(2,29)30/h3,6-7,9-10,14-15H,4-5,8,11-13H2,1-2H3