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

Systemtic Name: 3-[6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)benzimidazol-1-yl]propyl methanesulfonate Openeye Name: 3-[6-[2-(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-(2-pyridinyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-1-benzimidazolyl]propyl ester IUPAC Name: 3-[6-(2-pyridin-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-(2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]benzimidazol-1-yl]propyl ester Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCN1C=NC2=C1C=C(C=C2)C3=C4CCCN4N=C3C5=CC=CC=N5

Isomeric SMILES

CS(=O)(=O)OCCCN1C=NC2=C1C=C(C=C2)C3=C4CCCN4N=C3C5=CC=CC=N5

InChI

InChI=1S/C22H23N5O3S/c1-31(28,29)30-13-5-11-26-15-24-17-9-8-16(14-20(17)26)21-19-7-4-12-27(19)25-22(21)18-6-2-3-10-23-18/h2-3,6,8-10,14-15H,4-5,7,11-13H2,1H3