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

Systemtic Name: ethyl 1-(phenylmethyl)-5-(2-thiophen-2-ylethanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Openeye Name: ethyl 1-benzyl-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-(phenylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-(2-thiophen-2-ylacetyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Traditional Name: 1-benzyl-5-[2-(2-thienyl)acetyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S/c1-2-28-22(27)21-18-15-24(20(26)13-17-9-6-12-29-17)11-10-19(18)25(23-21)14-16-7-4-3-5-8-16/h3-9,12H,2,10-11,13-15H2,1H3