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

Systemtic Name: ethyl 1-(pyridin-2-ylmethyl)-5-(2-thiophen-3-ylethanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Openeye Name: ethyl 1-(2-pyridylmethyl)-5-[2-(3-thienyl)acetyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate CAS Name: 5-[1-oxo-2-(3-thiophenyl)ethyl]-1-(2-pyridinylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(pyridin-2-ylmethyl)-5-(2-thiophen-3-ylacetyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Traditional Name: 1-(2-pyridylmethyl)-5-[2-(3-thienyl)acetyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CN(CC2)C(=O)CC3=CSC=C3)CC4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CN(CC2)C(=O)CC3=CSC=C3)CC4=CC=CC=N4

InChI

InChI=1S/C21H22N4O3S/c1-2-28-21(27)20-17-13-24(19(26)11-15-7-10-29-14-15)9-6-18(17)25(23-20)12-16-5-3-4-8-22-16/h3-5,7-8,10,14H,2,6,9,11-13H2,1H3