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

Systemtic Name: ethyl 1-(pyridin-4-ylmethyl)-5-(2-thiophen-2-ylethanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Openeye Name: ethyl 1-(4-pyridylmethyl)-5-[2-(2-thienyl)acetyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate CAS Name: 5-(1-oxo-2-thiophen-2-ylethyl)-1-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(pyridin-4-ylmethyl)-5-(2-thiophen-2-ylacetyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Traditional Name: 1-(4-pyridylmethyl)-5-[2-(2-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=CC=CS3)CC4=CC=NC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CN(CC2)C(=O)CC3=CC=CS3)CC4=CC=NC=C4

InChI

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