(2S)-1-[[4-(3-oxidanylprop-1-ynyl)thiophen-2-yl]methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-2-carboxamide

Systemtic Name: (2S)-1-[[4-(3-oxidanylprop-1-ynyl)thiophen-2-yl]methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-2-carboxamide Openeye Name: (2S)-1-[[4-(3-hydroxyprop-1-ynyl)-2-thienyl]methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-2-carboxamide CAS Name: (2S)-1-[[4-(3-hydroxyprop-1-ynyl)-2-thiophenyl]methyl]-N-[4-(1-pyrazolyl)phenyl]-2-piperidinecarboxamide IUPAC Name: (2S)-1-[[4-(3-hydroxyprop-1-ynyl)thiophen-2-yl]methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-2-carboxamide Traditional Name: (2S)-1-[[4-(3-hydroxyprop-1-ynyl)-2-thienyl]methyl]-N-(4-pyrazol-1-ylphenyl)pipecolinamide Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=CC=C(C=C2)N3C=CC=N3)CC4=CC(=CS4)C#CCO

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)NC2=CC=C(C=C2)N3C=CC=N3)CC4=CC(=CS4)C#CCO

InChI

InChI=1S/C23H24N4O2S/c28-14-3-5-18-15-21(30-17-18)16-26-12-2-1-6-22(26)23(29)25-19-7-9-20(10-8-19)27-13-4-11-24-27/h4,7-11,13,15,17,22,28H,1-2,6,12,14,16H2,(H,25,29)/t22-/m0/s1