(3S)-1-[(5-chloranylthiophen-2-yl)methyl]-N-(3-pyrazol-1-ylphenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(5-chloranylthiophen-2-yl)methyl]-N-(3-pyrazol-1-ylphenyl)piperidine-3-carboxamide Openeye Name: (3S)-1-[(5-chloro-2-thienyl)methyl]-N-(3-pyrazol-1-ylphenyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(5-chloro-2-thiophenyl)methyl]-N-[3-(1-pyrazolyl)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(5-chlorothiophen-2-yl)methyl]-N-(3-pyrazol-1-ylphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-[(5-chloro-2-thienyl)methyl]-N-(3-pyrazol-1-ylphenyl)nipecotamide Formula: C20H21ClN4OS MolecularWeight: 400.92494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=C(S2)Cl)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

Isomeric SMILES

C1C[C@@H](CN(C1)CC2=CC=C(S2)Cl)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

InChI

InChI=1S/C20H21ClN4OS/c21-19-8-7-18(27-19)14-24-10-2-4-15(13-24)20(26)23-16-5-1-6-17(12-16)25-11-3-9-22-25/h1,3,5-9,11-12,15H,2,4,10,13-14H2,(H,23,26)/t15-/m0/s1