ethyl 1-(2-phenyl-5-thiophen-2-yl-pyrazol-3-yl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-phenyl-5-thiophen-2-yl-pyrazol-3-yl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-phenyl-5-(2-thienyl)pyrazole-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-(2-phenyl-5-thiophen-2-yl-3-pyrazolyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-phenyl-5-thiophen-2-ylpyrazole-3-carbonyl)piperidine-4-carboxylate Traditional Name: 1-[2-phenyl-5-(2-thienyl)pyrazole-3-carbonyl]isonipecotic acid ethyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CS4

InChI

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