N-[2-(4-pyrazol-1-ylphenyl)ethyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(4-pyrazol-1-ylphenyl)ethyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[2-(4-pyrazol-1-ylphenyl)ethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(4-pyrazol-1-ylphenyl)ethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[2-(4-pyrazol-1-ylphenyl)ethyl]-1-(2-thenoyl)nipecotamide Formula: C22H24N4O2S MolecularWeight: 408.51656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C22H24N4O2S/c27-21(18-4-1-13-25(16-18)22(28)20-5-2-15-29-20)23-12-10-17-6-8-19(9-7-17)26-14-3-11-24-26/h2-3,5-9,11,14-15,18H,1,4,10,12-13,16H2,(H,23,27)