ethyl 1-ethyl-5-(2-pyridin-2-ylsulfanylethanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate

Systemtic Name: ethyl 1-ethyl-5-(2-pyridin-2-ylsulfanylethanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Openeye Name: ethyl 1-ethyl-5-[2-(2-pyridylsulfanyl)acetyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate CAS Name: 1-ethyl-5-[1-oxo-2-(2-pyridinylthio)ethyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-5-(2-pyridin-2-ylsulfanylacetyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Traditional Name: 1-ethyl-5-[2-(2-pyridylthio)acetyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CN(CC2)C(=O)CSC3=CC=CC=N3)C(=N1)C(=O)OCC

Isomeric SMILES

CCN1C2=C(CN(CC2)C(=O)CSC3=CC=CC=N3)C(=N1)C(=O)OCC

InChI

InChI=1S/C18H22N4O3S/c1-3-22-14-8-10-21(11-13(14)17(20-22)18(24)25-4-2)16(23)12-26-15-7-5-6-9-19-15/h5-7,9H,3-4,8,10-12H2,1-2H3