(phenylmethyl) 3-[3-cyclopropyl-7-(pyridin-3-ylsulfonylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[3-cyclopropyl-7-(pyridin-3-ylsulfonylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate Openeye Name: benzyl 3-[3-cyclopropyl-7-(3-pyridylsulfonylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate CAS Name: 3-[3-cyclopropyl-7-(3-pyridinylsulfonylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[3-cyclopropyl-7-(pyridin-3-ylsulfonylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate Traditional Name: 3-[3-cyclopropyl-7-(3-pyridylsulfonylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylic acid benzyl ester Formula: C27H28N6O4S MolecularWeight: 532.61402

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)C3=NC4=C(C=NN4C(=C3)NS(=O)(=O)C5=CN=CC=C5)C6CC6

Isomeric SMILES

C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)C3=NC4=C(C=NN4C(=C3)NS(=O)(=O)C5=CN=CC=C5)C6CC6

InChI

InChI=1S/C27H28N6O4S/c34-27(37-18-19-6-2-1-3-7-19)32-13-5-8-21(17-32)24-14-25(31-38(35,36)22-9-4-12-28-15-22)33-26(30-24)23(16-29-33)20-10-11-20/h1-4,6-7,9,12,14-16,20-21,31H,5,8,10-11,13,17-18H2