(3S)-1-(2-pyrazol-1-ylethanoyl)-N-[4-(1,3-thiazol-4-yl)phenyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(2-pyrazol-1-ylethanoyl)-N-[4-(1,3-thiazol-4-yl)phenyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(2-pyrazol-1-ylacetyl)-N-(4-thiazol-4-ylphenyl)piperidine-3-carboxamide CAS Name: (3S)-1-[1-oxo-2-(1-pyrazolyl)ethyl]-N-[4-(4-thiazolyl)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(2-pyrazol-1-ylacetyl)-N-[4-(1,3-thiazol-4-yl)phenyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(2-pyrazol-1-ylacetyl)-N-(4-thiazol-4-ylphenyl)nipecotamide Formula: C20H21N5O2S MolecularWeight: 395.47804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2C=CC=N2)C(=O)NC3=CC=C(C=C3)C4=CSC=N4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CN2C=CC=N2)C(=O)NC3=CC=C(C=C3)C4=CSC=N4

InChI

InChI=1S/C20H21N5O2S/c26-19(12-25-10-2-8-22-25)24-9-1-3-16(11-24)20(27)23-17-6-4-15(5-7-17)18-13-28-14-21-18/h2,4-8,10,13-14,16H,1,3,9,11-12H2,(H,23,27)/t16-/m0/s1